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Publications at RICC

Published on 8 December 2018

Synthesis and reactivity of a terminal uranium(IV) sulfide supported by siloxide ligands
Andrez J, Pecaut J, Scopelliti R, Kefalidis CE, Maron L, Rosenzweig MW, Meyere K and Mazzanti M
Chemical Science 7 (2016) 5846-5856

Nickel-centred proton reduction catalysis in a model of NiFe hydrogenase
Brazzolotto D, Gennari M, Queyriaux N, Simmons TR, Pecaut J, Demeshko S, Meyer F, Orio M, Artero V and Duboc C
Nature Chemistry 8 (2016) 1054-1060

An Experimental and Theoretical Investigation on Pentacoordinated Cobalt(III) Complexes with an Intermediate S=1 Spin State: How Halide Ligands Affect their Magnetic Anisotropy
Brazzolotto D, Gennari M, Yu S, Pecaut J, Rouzieres M, Clerac R, Orio M and Duboc C
Chemistry-a European Journal 22 (2016) 925-933

Li-Rich Mn/Ni Layered Oxide as Electrode Material for Lithium Batteries: A Li-7 MAS NMR Study Revealing Segregation into (Nanoscale) Domains with Highly Different Electrochemical Behaviors
Buzlukov A, Mouesca J-M, Buannic L, Hediger S, Simonin L, Canevet E, Colin J-F, Gutel T and Bardet M
Journal of Physical Chemistry C 120 (2016) 19049-19063

Synthesis, optoelectronic properties and photovoltaic performances of wide band-gap copolymers based on dibenzosilole and quinoxaline units, rivals to P3HT
Caffy F, Delbosc N, Chavez P, Leveque P, Faure-Vincent J, Travers JP, Djurado D, Pecaut J, Grevin B, Lemaitre N, et al.
Polymer Chemistry 7 (2016) 4160-4175

Versatile pyridine-2,6-bis-tetrazolate scaffolds for the formation of highly luminescent lanthanide complexes
Di Pietro S, Gautier N, Imbert D, Pecaut J and Mazzanti M
Dalton Transactions 45 (2016) 3429-3442

Redox-Innocent Metal-Assisted Cleavage of S-S Bond in a Disulfide-Containing Ligand
Esmieu C, Orio M, Le Pape L, Lebrun C, Pecaut J, Menage S and Torelli S
Inorganic Chemistry 55 (2016) 6208-6217

Enhancement of silicon solar cells by downshifting with Eu and Tb coordination complexes
Fix T, Nonat A, Imbert D, Di Pietro S, Mazzanti M, Slaoui A and Charbonniere LJ
Progress in Photovoltaics 24 (2016) 1251-1260

Enhanced Spin Pumping Efficiency in Antiferromagnetic IrMn Thin Films around the Magnetic Phase Transition
Frangou L, Oyarzun S, Auffret S, Vila L, Gambarelli S and Baltz V
Physical Review Letters 116 (2016) 077203

Manganese-calcium/strontium heterometallic compounds and their relevance for the oxygen-evolving center of photosystem II
Gerey B, Goure E, Fortage J, Pecaut J and Collomb M-N
Coordination Chemistry Reviews 319 (2016) 1-24

In vivo quantification of magnetically labelled cells by MRI relaxometry
Gimenez U, Lajous H, El Atifi M, Bidart M, Auboiroux V, Fries PH, Berger F and Lahrech H
Contrast Media & Molecular Imaging 11 (2016) 535-543

Intramolecular Electron Transfers Thwart Bistability in a Pentanuclear Iron Complex
Goure E, Gerey B, Clemancey M, Pecaut J, Molton F, Latour J-M, Blondin G and Collomb M-N
Inorganic Chemistry 55 (2016) 9178-9186

Evidence for Charge Transfer at the Interface between Hybrid Phosphomolybdate and Epitaxial Graphene
Huder L, Rinfray C, Rouchon D, Benayad A, Baraket M, Izzet G, Lipp-Bregolin F, Lapertot G, Dubois L, Proust A, et al.
Langmuir 32 (2016) 4774-4783
HAL <hal-01700875>

Perylene-Based All-Organic Redox Battery with Excellent Cycling Stability
Iordache A, Delhorbe V, Bardet M, Dubois L, Gutel T and Picard L
ACS Applied Materials and Interfaces 8 (2016) 22762-22767

Covalent Design for Dye-Sensitized H-2-Evolving Photocathodes Based on a Cobalt Diimine-Dioxime Catalyst
Kaeffer N, Massin J, Lebrun C, Renault O, Chavarot-Kerlidou M and Artero V
Journal of the American Chemical Society 138 (2016) 12308-12311

Ga-In intermixing, intrinsic doping, and Wigner localization in the emission spectra of self-organized InP/GaInP quantum dots
Kapaldo J, Rouvimov S, Merz JL, Oktyabrsky S, Blundell SA, Bert N, Brunkov P, Kalyuzhnyy NA, Mintairov SA, Nekrasov S, et al.
Journal of Physics D-Applied Physics 49 (2016) 475301

Growth protocols and characterization of epitaxial graphene on SiC elaborated in a graphite enclosure
Kumar B, Baraket M, Paillet M, Huntzinger JR, Tiberj A, Jansen AGM, Vila L, Cubuku M, Vergnaud C, Jamet M, et al.
Physica E-Low-Dimensional Systems and Nanostructures 75 (2016) 7-14

Highly efficient and tunable spin-to-charge conversion through Rashba coupling at oxide interfaces
Lesne E, Fu Y, Oyarzun S, Rojas-Sanchez JC, Vaz DC, Naganuma H, Sicoli G, Attane J-P, Jamet M, Jacquet E, et al.
Nature Materials 15 (2016) 1261-1266
HAL <hal-01614031>

Unanticipated coordination of tris buffer to the Radical SAM cluster of the RimO methylthiotransferase
Molle T, Clemancey M, Latour J-M, Kathirvelu V, Sicoli G, Forouhar F, Mulliez E, Gambarelli S and Atta M
Journal of Biological Inorganic Chemistry 21 (2016) 549-557

Redox Behavior of the S-Adenosylmethionine (SAM)-Binding Fe-S Cluster in Methylthiotransferase RimO, toward Understanding Dual SAM Activity
Molle T, Moreau Y, Clemancey M, Forouhar F, Ravanat J-L, Duraffourg N, Fourmond V, Latour J-M, Gambarelli S, Mulliez E, et al.
Biochemistry 55 (2016) 5798-5808

Sensitisation of visible and NIR lanthanide emission by InPZnS quantum dots in bi-luminescent hybrids
Molloy JK, Lincheneau C, Karimdjy MM, Agnese F, Mattera L, Gateau C, Reiss P, Imbert D and Mazzanti M
Chemical Communications 52 (2016) 4577-4580

ASGPR-Mediated Uptake of Multivalent Glycoconjugates for Drug Delivery in Hepatocytes
Monestier M, Charbonnier P, Gateau C, Cuillel M, Robert F, Lebrun C, Mintz E, Renaudet O and Delangle P
Chembiochem 17 (2016) 590-594

Evidence for spin-to-charge conversion by Rashba coupling in metallic states at the Fe/Ge(111) interface
Oyarzun S, Nandy AK, Rortais F, Rojas-Sanchez JC, Dau MT, Noel P, Laczkowski P, Pouget S, Okuno H, Vila L, et al.
Nature Communications 7 (2016) 13857
HAL <hal-01614036>

DFT analysis of the electronic structure of Fe(IV) species active in nitrene transfer catalysis: influence of the coordination sphere
Patra R and Maldivi P
Journal of Molecular Modeling 22 (2016) 278

Origin of the Enhanced Reactivity of mu-Nitrido-Bridged Diiron(IV)-Oxo Porphyrinoid Complexes over Cytochrome P450 Compound I
Quesne MG, Senthilnathan D, Singh D, Kumar D, Maldivi P, Sorokin AB and de Visser SP
ACS Catalysis 6 (2016) 2230-2243

Polarized Neutron Diffraction as a Tool for Mapping Molecular Magnetic Anisotropy: Local Susceptibility Tensors in Co-II Complexes
Ridier K, Gillon B, Gukasov A, Chaboussant G, Cousson A, Luneau D, Borta A, Jacquot J-F, Checa R, Chiba Y, et al.
Chemistry-a European Journal 22 (2016) 724-735

Carbon-sulfur bond-forming reaction catalysed by the radical SAM enzyme HydE
Rohac R, Amara P, Benjdia A, Martin L, Ruffie P, Favier A, Berteau O, Mouesca J-M, Fontecilla-Camps JC and Nicolet Y
Nature Chemistry 8 (2016) 491-500

Spin to Charge Conversion at Room Temperature by Spin Pumping into a New Type of Topological Insulator: alpha-Sn Films
Rojas-Sanchez JC, Oyarzun S, Fu Y, Marty A, Vergnaud C, Gambarelli S, Vila L, Jamet M, Ohtsubo Y, Taleb-Ibrahimi A, et al.
Physical Review Letters 116 (2016) 096602
HAL <hal-01614026>

Spin transport in p-type germanium
Rortais F, Oyarzun S, Bottegoni F, Rojas-Sanchez JC, Laczkowski P, Ferrari A, Vergnaud C, Ducruet C, Beigne C, Reyren N, et al.
Journal of Physics-Condensed Matter 28 (2016) 165801
HAL <hal-01614027>

Fine-tuning of a radical-based reaction by radical S-adenosyl-L-methionine tryptophan lyase
Sicoli G, Mouesca J-M, Zeppieri L, Amara P, Martin L, Barra A-L, Fontecilla-Camps JC, Gambarelli S and Nicolet Y
Science 351 (2016) 1320-1323

Non-conductive ferromagnets based on core double-shell nanoparticles for radio-electric applications
Takacs H, Viala B, Herman V, Tortai J-H, Duclairoir F, Ramos JA, Jouneau P-H, Okuno H and Tallec G
Springerplus 5 (2016) 496

Non-conductive ferromagnetic carbon-coated (Co, Ni) metal/polystyrene nanocomposites films
Takacs H, Viala B, Tortai JH, Herman V and Duclairoir F
Journal of Applied Physics 119 (2016) 093907

Visualization, quantification and coordination of Ag+ ions released from silver nanoparticles in hepatocytes
Veronesi G, Deniaud A, Gallon T, Jouneau P-H, Villanova J, Delangle P, Carriere M, Kieffer I, Charbonnier P, Mintz E, et al.
Nanoscale 8 (2016) 17012-17021

s-Heptazine oligomers: promising structural models for graphitic carbon nitride
Zambon A, Mouesca JM, Gheorghiu C, Bayle PA, Pecaut J, Claeys-Bruno M, Gambarelli S and Dubois L
Chemical Science 7 (2016) 945-950


Lanthanide(II) Complexes Supported by N,O-Donor Tripodal Ligands: Synthesis, Structure, and Ligand-Dependent Redox Behavior
Andrez J, Bozoklu G, Nocton G, Pecaut J, Scopelliti R, Dubois L and Mazzanti M
Chemistry-a European Journal 21 (2015) 15188-15200
HAL <cea-01570111>

How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II
Beckwith MA, Ames W, Vila FD, Krewald V, Pantazis DA, Mantel C, Pecaut J, Gennari M, Duboc C, Collomb M-N, et al.
Journal of the American Chemical Society 137 (2015) 12815-12834
HAL <hal-01586119>

Pushing NMR sensitivity limits using dynamic nuclear polarization with closed-loop cryogenic helium sample spinning
Bouleau E, Saint-Bonnet P, Mentink-Vigier F, Takahashi H, Jacquot J-F, Bardet M, Aussenac F, Purea A, Engelke F, Hediger S, et al.
Chemical Science 6 (2015) 6806-6812
HAL <hal-01587521>

CO2 conversion to isocyanate via multiple N-Si bond cleavage at a bulky uranium(III) complex
Camp C, Chatelain L, Kefalidis CE, Pecaut J, Maron L and Mazzanti M
Chemical Communications 51 (2015) 15454-15457
HAL <hal-01588142>

Ferrocene-Based Tetradentate Schiff Bases as Supporting Ligands in Uranium Chemistry
Camp C, Chatelain L, Mougel V, Pecaut J and Mazzanti M
Inorganic Chemistry 54 (2015) 5774-5783
HAL <hal-01588141>

CS2 activation at uranium(III) siloxide ate complexes: the effect of a Lewis acidic site
Camp C, Cooper O, Andrez J, Pecaut J and Mazzanti M
Dalton Transactions 44 (2015) 2650-2656
HAL <hal-01588140>

Heterometallic Fe-2(II)-U-V and Ni-2(II)-U-V Exchange-Coupled Single-Molecule Magnets: Effect of the 3d Ion on the Magnetic Properties
Chatelain L, Pecaut J, Tuna F and Mazzanti M
Chemistry-a European Journal 21 (2015) 18038-18042
HAL <hal-01588165>

A zig-zag uranyl(V)- Mn(II) single chain magnet with a high relaxation barrier
Chatelain L, Tuna F, Pecaut J and Mazzanti M
Chemical Communications 51 (2015) 11309-11312
HAL <hal-01588164>

Redox Photocatalysis with Water-Soluble Core Shell CdSe-ZnS Quantum Dots
Chauvire T, Mouesca J-M, Gasparutto D, Ravanat J-L, Lebrun C, Gromova M, Jouneau P-H, Chauvin J, Gambarelli S and Maurel V
Journal of Physical Chemistry C 119 (2015) 17857-17866
HAL <hal-01588163>

Synthesis, Internal Structure, and Formation Mechanism of Monodisperse Tin Sulfide Nanoplatelets
de Kergommeaux A, Lopez-Haro M, Pouget S, Zuo J-M, Lebrun C, Chandezon F, Aldakov D and Reiss P
Journal of the American Chemical Society 137 (2015) 9943-9952
HAL <hal-01589469>

Surface-Confined Supramolecular Self-Assembly of Molecular Nanocranes for Chemically Lifting and Positioning C-60 above a Conducting Substrate
Du P, Kreher D, Mathevet F, Maldivi P, Charra F and Attias A-J
Chemphyschem 16 (2015) 3774-3778
HAL <cea-01483788>

Matrix-Free DNP-Enhanced NMR Spectroscopy of Liposomes Using a Lipid-Anchored Biradical
Fernandez-de-Alba C, Takahashi H, Richard A, Chenavier Y, Dubois L, Maurel V, Lee D, Hediger S and De Paepe G
Chemistry-a European Journal 21 (2015) 4512-4517
HAL <hal-01592879>

Simple expressions of the nuclear relaxation rate enhancement due to quadrupole nuclei in slowly tumbling molecules
Fries PH and Belorizky E
Journal of Chemical Physics 143 (2015) 044202
HAL <hal-01592972>

Dioxygen Activation and Catalytic Reduction to Hydrogen Peroxide by a Thiolate-Bridged Dimanganese(II) Complex with a Pendant Thiol
Gennari M, Brazzolotto D, Pecaut J, Cherrier MV, Pollock CJ, DeBeer S, Retegan M, Pantazis DA, Neese F, Rouzieres M, et al.
Journal of the American Chemical Society 137 (2015) 8644-8653
HAL <hal-01235333>

Effect of the Metal on Disulfide/Thiolate Interconversion: Manganese versus Cobalt
Gennari M, Brazzolotto D, Yu S, Pecaut J, Philouze C, Rouzieres M, Clerac R, Orio M and Duboc C
Chemistry-a European Journal 21 (2015) 18770-18778
HAL <hal-01441956>

Calcium and heterometallic manganese-calcium complexes supported by tripodal pyridine-carboxylate ligands: structural, EPR and theoretical investigations
Gerey B, Gennari M, Goure E, Pecaut J, Blackman A, Pantazis DA, Neese F, Molton F, Fortage J, Duboc C, et al.
Dalton Transactions 44 (2015) 12757-12770
HAL <hal-01593305>

Deprotonation in Mixed-Valent Diiron(II, III) Complexes with Aniline or Benzimidazole Ligands
Goure E, Carboni M, Troussier A, Dubourdeaux P, Clemancey M, Gon N, Balasubramanian R, Lebrun C, Pecaut J, Blondin G, et al.
Inorganic Chemistry 54 (2015) 6257-6266
HAL <hal-01211562>

Phosphoester Hydrolysis: The Incoming Substrate Turns the Bridging Hydroxido Nucleophile into a Terminal One
Goure E, Carboni M, Troussier A, Lebrun C, Pecaut J, Jacquot J-F, Dubourdeaux P, Clemancey M, Blondin G and Latour J-M
Chemistry-a European Journal 21 (2015) 8064-8068
HAL <hal-01168103>

Cobalt(III) tetraaza-macrocyclic complexes as efficient catalyst for photoinduced hydrogen production in water: Theoretical investigation of the electronic structure of the reduced species and mechanistic insight
Gueret R, Castillo CE, Rebarz M, Thomas F, Hargrove A-A, Pecaut J, Sliwa M, Fortage J and Collomb M-N
Journal of Photochemistry and Photobiology B-Biology 152 (2015) 82-94
HAL <hal-01261601>

Core double-shell cobalt/graphene/polystyrene magnetic nanocomposites synthesized by in situ sonochemical polymerization
Herman V, Takacs H, Duclairoir F, Renault O, Tortai JH and Viala B
RSC Advances 5 (2015) 51371-51381
HAL <hal-01611025>

A Ruthenium(II)-Copper(II) Dyad for the Photocatalytic Oxygenation of Organic Substrates Mediated by Dioxygen Activation
Iali W, Lanoe P-H, Torelli S, Jouvenot D, Loiseau F, Lebrun C, Hamelin O and Menage S
Angewandte Chemie-International Edition 54 (2015) 8415-8419
HAL <hal-01179368>

Organic dyes for the sensitization of nanostructured ZnO photoanodes: effect of the anchoring functions
Idigoras J, Godfroy M, Joly D, Todinova A, Maldivi P, Oskam G, Demadrille R and Anta JA
RSC Advances 5 (2015) 68929-68938
HAL <hal-01611293>

Lanthanide Luminescence Modulation by Cation-pi Interaction in a Bioinspired Scaffold: Selective Detection of Copper(I)
Isaac M, Denisov SA, Roux A, Imbert D, Jonusauskas G, McClenaghan ND and Seneque O
Angewandte Chemie-International Edition 54 (2015) 11453-11456
HAL <hal-01211550>

Reactivity of Cys(4) Zinc Finger Domains with Gold(III) Complexes: Insights into the Formation of "Gold Fingers"
Jacques A, Lebrun C, Casini A, Kieffer I, Proux O, Latour J-M and Seneque O
Inorganic Chemistry 54 (2015) 4104-4113
HAL <hal-01168034>

Metal-free organic sensitizers with narrow absorption in the visible for solar cells exceeding 10% efficiency
Joly D, Pelleja L, Narbey S, Oswald F, Meyer T, Kervella Y, Maldivi P, Clifford JN, Palomares E and Demadrille R
Energy & Environmental Science 8 (2015) 2010-2018

Pseudo-peptides Based on Methyl Cysteine or Methionine Inspired from Mets Motifs Found in the Copper Transporter Ctr1
Jullien A-S, Gateau C, Lebrun C and Delangle P
Inorganic Chemistry 54 (2015) 2339-2344

Mercury Complexes with Tripodal Pseudopeptides Derived from D-Penicillamine Favour a HgS3 Coordination
Jullien A-S, Gateau C, Lebrun C and Delangle P
European Journal of Inorganic Chemistry 2015 (2015) 3674-3680

Reactivity of a Zn(Cys)(2)(His)(2) Zinc Finger with Singlet Oxygen: Oxidation Directed toward Cysteines but not Histidines
Lebrun V, Tron A, Lebrun C, Latour J-M, McClenaghan ND and Seneque O
Chemistry-a European Journal 21 (2015) 14002-14010
HAL <hal-01208335>

Solid-State NMR and DFT Combined for the Surface Study of Functionalized Silicon Nanoparticles
Lee D, Kaushik M, Coustel R, Chenavier Y, Chanal M, Bardet M, Dubois L, Okuno H, Rochat N, Duclairoir F, et al.
Chemistry-a European Journal 21 (2015) 16047-16058
HAL <hal-01507024>

Ca K-Edge XAS as a Probe of Calcium Centers in Complex Systems
Martin-Diaconescu V, Gennari M, Gerey B, Tsui E, Kanady J, Tran R, Pecaut J, Maganas D, Krewald V, Goure E, et al.
Inorganic Chemistry 54 (2015) 1283-1292

Magnetic reversal in Mn5Ge3 thin films: an extensive study
Michez LA, Spiesser A, Petit M, Bertaina S, Jacquot JF, Dufeu D, Coudreau C, Jamet M and Le Thanh V
Journal of Physics-Condensed Matter 27 (2015) 266001
HAL <hal-01164549>

Confinement of a tris-aqua Gd(III) complex in silica nanoparticles leads to high stability and high relaxivity and supresses anion binding
Moula Karimdjy M, Tallec G, Fries PH, Imbert D and Mazzanti M
Chemical Communications 51 (2015) 6836-6838

Bromine-lithium exchange as a straightforward method to obtain meso-tetrakis(4-formylphenyl)porphyrin: a versatile intermediate
Oenal E, Ahsen V, Pecaut J, Luneau D and Hirel C
Tetrahedron Letters 56 (2015) 5157-5160

Formation of High-Spin States (S=3/2 and 2) in Linear Oligo- and Polyarylamines
Skorka L, Mouesca J-M, Dubois L, Szewczyk E, Wielgus I, Maurel V and Kulszewicz-Bajer I
Journal of Physical Chemistry B 119 (2015) 13462-13471

Preorganized Peptide Scaffolds as Mimics of Phosphorylated Proteins Binding Sites with a High Affinity for Uranyl
Starck M, Sisommay N, Laporte FA, Oros S, Lebrun C and Delangle P
Inorganic Chemistry 54 (2015) 11557-11562

New Approach to Closely Spaced Disordered Cobalt-Graphene Polymer Nanocomposites for Non-Conductive RF Ferromagnetic Films
Takacs H, Viala B, Herman V, Ramos JA, Tortai JH and Duclairoir F
IEEE Transactions on Magnetics 51 (2015) 2802304

Exposure-dependent Ag+ release from silver nanoparticles and its complexation in AgS2 sites in primary murine macrophages
Veronesi G, Aude-Garcia C, Kieffer I, Gallon T, Delangle P, Herlin-Boime N, Rabilloud T and Carriere M
Nanoscale 7 (2015) 7323-7330
HAL <hal-01157525>

XAS Investigation of Silver(I) Coordination in Copper(I) Biological Binding Sites
Veronesi G, Gallon T, Deniaud A, Boff B, Gateau C, Lebrun C, Vidaud C, Rollin-Genetet F, Carriere M, Kieffer I, et al.
Inorganic Chemistry 54 (2015) 11688-11696
HAL <hal-01278444>


Tuning Lanthanide Reactivity Towards Small Molecules with Electron-Rich Siloxide Ligands
Andrez J, Pecaut J, Bayle P-A and Mazzanti M
Angewandte Chemie-International Edition 53 (2014) 10448-10452

Calculation of fine-structure splittings in high-lying F-2 states of rubidium
Blundell SA
Physical Review A 90 (2014) 042514

Two-electron versus one-electron reduction of chalcogens by uranium(III): synthesis of a terminal U(V) persulfide complex
Camp C, Antunes MA, Garcia G, Ciofini I, Santos IC, Pecaut J, Almeida M, Marcalo J and Mazzanti M
Chemical Science 5 (2014) 841-846

Self-Assembly of a 3d-5f Trinuclear Single-Molecule Magnet from a Pentavalent Uranyl Complex
Chatelain L, Walsh JPS, Pecaut J, Tuna F and Mazzanti M
Angewandte Chemie-International Edition 53 (2014) 13434-13438

Multimetallic Cooperativity in Uranium-Mediated CO2 Activation
Cooper O, Camp C, Pecaut J, Kefalidis CE, Maron L, Gambarelli S and Mazzanti M
Journal of the American Chemical Society 136 (2014) 6716-6723

Mimic the living to trap radionuclides
Delangle P and Berthomieu C
Biofutur 353 (2014) 39-42

An efficient triazole-pyridine-bistetrazolate platform for highly luminescent lanthanide complexes
Di Pietro S, Imbert D and Mazzanti M
Chemical Communications 50 (2014) 10323-10326

From gold porphyrins to gold nanoparticles: catalytic nanomaterials for glucose oxidation
Elouarzaki K, Le Goff A, Holzinger M, Agnes C, Duclairoir F, Putaux J-L and Cosnier S
Nanoscale 6 (2014) 8556-8560
HAL <hal-01652192>

N2O reduction at a dissymmetric {Cu2S}-containing mixed-valent center
Esmieu C, Orio M, Torelli S, Le Pape L, Pecaut J, Lebrun C and Menage S
Chemical Science 5 (2014) 4774-4784

A Bio-Inspired Switch Based on Cobalt(II) Disulfide/Cobalt(III) Thiolate Interconversion
Gennari M, Gerey B, Hall N, Pecaut J, Collomb M-N, Rouzieres M, Clerac R, Orio M and Duboc C
Angewandte Chemie-International Edition 53 (2014) 5318-5321

A Diiron(III,IV) Imido Species Very Active in Nitrene-Transfer Reactions
Goure E, Avenier F, Dubourdeaux P, Seneque O, Albrieux F, Lebrun C, Clemancey M, Maldivi P and Latour J-M
Angewandte Chemie-International Edition 53 (2014) 1580-1584

Cis/Trans Isomerizations in Diiron Complexes Involving Aniline or Anilide Ligands
Goure E, Carboni M, Dubourdeaux P, Clemancey M, Balasubramanian R, Lebrun C, Bayle P-A, Maldivi P, Blondin G and Latour J-M
Inorganic Chemistry 53 (2014) 10060-10069

Monothioanthraquinone as an organic active material for greener lithium batteries
Iordache A, Maurel V, Mouesca J-M, Pecaut J, Dubois L and Gutel T
Journal of Power Sources 267 (2014) 553-559

D-Penicillamine Tripodal Derivatives as Efficient Copper(I) Chelators
Jullien A-S, Gateau C, Lebrun C, Kieffer I, Testemale D and Delangle P
Inorganic Chemistry 53 (2014) 5229-5239

Engineering Short Peptide Sequences for Uranyl Binding
Lebrun C, Starck M, Gathu V, Chenavier Y and Delangle P
Chemistry-a European Journal 20 (2014) 16566-16573

Efficient Oxidation and Destabilization of Zn(Cys)(4) Zinc Fingers by Singlet Oxygen
Lebrun V, Tron A, Scarpantonio L, Lebrun C, Ravanat J-L, Latour J-M, McClenaghan ND and Seneque O
Angewandte Chemie-International Edition 53 (2014) 9365-9368

Ferromagnetic Spin Coupling through the 3,4 '-Biphenyl Moiety in Arylamine Oligomers-Experimental and Computational Study
Maurel V, Skorka L, Onofrio N, Szewczyk E, Djurado D, Dubois L, Mouesca J-M and Kulszewicz-Bajer I
Journal of Physical Chemistry B 118 (2014) 7657-7667

A Uranium-Based UO2+-Mn2+ Single-Chain Magnet Assembled trough Cation-Cation Interactions
Mougel V, Chatelain L, Hermle J, Caciuffo R, Colineau E, Tuna F, Magnani N, de Geyer A, Pecaut J and Mazzanti M
Angewandte Chemie-International Edition 53 (2014) 819-823

Single-Molecule-Magnet Behavior in Mononuclear Homoleptic Tetrahedral Uranium(III) Complexes
Pereira LCJ, Camp C, Coutinho JT, Chatelain L, Maldivi P, Almeida M and Mazzanti M
Inorganic Chemistry 53 (2014) 11809-11811

New semiconducting naphthalene bisimides N-substituted with alkoxyphenyl groups: spectroscopic, electrochemical, structural and electrical properties
Rybakiewicz R, Tszydel I, Zapala J, Skorka L, Wamil D, Djurado D, Pecaut J, Ulanski J, Zagorska M and Pron A
RSC Advances 4 (2014) 14089-14100

An efficient and cyclic hydrogen evolution reaction mechanism on Ni((P2N2H)-N-H)(2) (2+) catalysts: a theoretical and multiscale simulation study
Senthilnathan D, Giunta P, Vetere V, Kachmar A, Maldivi P and Franco AA
RSC Advances 4 (2014) 5177-5187


Redox behavior of a ferrocene monolayer on SiO2 obtained after click-coupling
Aiello V, Joo N, Buckley J, Nonglaton G, Duclairoir F, Dubois L, Marchon JC, Gely M, Chevalier N and De Salvo B
Surface Science 612 (2013) 57-62

DNA Sensing by a Eu-Binding Peptide Containing a Proflavine Unit
Ancel L, Gateau C, Lebrun C and Delangle P
Inorganic Chemistry 52 (2013) 552-554

Lanthanide Complexes Based on beta-Diketonates and a Tetradentate Chromophore Highly Luminescent as Powders and in Polymers
Andreiadis ES, Gauthier N, Imbert D, Demadrille R, Pecaut J and Mazzanti M
Inorganic Chemistry 52 (2013) 14382-14390

Molecular engineering of a cobalt-based electrocatalytic nanomaterial for H-2 evolution under fully aqueous conditions
Andreiadis ES, Jacques PA, Tran PD, Leyris A, Chavarot-Kerlidou M, Jousselme B, Matheron M, Pecaut J, Palacin S, Fontecave M, et al.
Nature Chemistry 5 (2013) 48-53

Crystal structure diversity in the bis hydrotris-(3,5-dimethylpyrazolyl)borate iodouranium(III) complex: from neutral to cationic forms
Antunes MA, Santos IC, Bolvin H, Pereira LCJ, Mazzanti M, Marcalo J and Almeida M
Dalton Transactions 42 (2013) 8861-8867

Synthesis of Electron-Rich Uranium(IV) Complexes Supported by Tridentate Schiff Base Ligands and Their Multi-Electron Redox Chemistry
Camp C, Andrez J, Pecaut J and Mazzanti M
Inorganic Chemistry 52 (2013) 7078-7086

Controlled Thermolysis of Uranium (Alkoxy) siloxy Complexes: A Route to Polymetallic Complexes of Low-Valent Uranium
Camp C, Kefalidis CE, Pecaut J, Maron L and Mazzanti M
Angewandte Chemie-International Edition 52 (2013) 12646-12650

Cation-Mediated Conversion of the State of Charge in Uranium Arene Inverted-Sandwich Complexes
Camp C, Mougel V, Pecaut J, Maron L and Mazzanti M
Chemistry-a European Journal 19 (2013) 17528-17540

Tuning Uranium-Nitrogen Multiple Bond Formation with Ancillary Siloxide Ligands
Camp C, Pecaut J and Mazzanti M
Journal of the American Chemical Society 135 (2013) 12101-12111

Catalytic hydrogen production by a Ni-Ru mimic of NiFe hydrogenases involves a proton-coupled electron transfer step
Canaguier S, Fourmond V, Perotto CU, Fize J, Pecaut J, Fontecave M, Field MJ and Artero V
Chemical Communications 49 (2013) 5004-5006

Magnetic properties and chiral states of a trimetallic uranium complex
Carretta S, Amoretti G, Santini P, Mougel V, Mazzanti M, Gambarelli S, Colineau E and Caciuffo R
Journal of Physics-Condensed Matter 25 (2013) 486001

Conformational Equilibria of Bridled Chiroporphyrins in Solution Investigated by Vibrational Circular Dichroism
Castaings A, Marchon J-C, Cavagnat D and Buffeteau T
Chirality 25 (2013) 480-486

Amorphous Zinc Stannate (Zn2SnO4) Nanofibers Networks as Photoelectrodes for Organic Dye-Sensitized Solar Cells
Choi S-H, Hwang D, Kim D-Y, Kervella Y, Maldivi P, Jang S-Y, Demadrille R and Kim I-D
Advanced Functional Materials 23 (2013) 3146-3155

Long-range electronic connection in picket-fence like ferrocene-porphyrin derivatives
Devillers CH, Milet A, Moutet JC, Pecaut J, Royal G, Saint-Aman E and Bucher C
Dalton Transactions 42 (2013) 1196-1209

Effect of structural anisotropy on electrical and magnetic properties of polyaniline conducting films
Fedorko P, Faure-Vincent J, Fier I, Walmsley L, Sniechowski M, Jacquot JF, Pron A, Travers JP and Djurado D
Synthetic Metals 166 (2013) 63-69

Experimental Measurement and Theoretical Assessment of Fast Lanthanide Electronic Relaxation in Solution with Four Series of Isostructural Complexes
Funk AM, Fries PH, Harvey P, Kenwright AM and Parker D
Journal of Physical Chemistry A 117 (2013) 905-917

Efficient sensitization of Ln(3+)-doped NaYF4 nanocrystals with organic ligands
Gauthier N, Raccurt O, Imbert D and Mazzanti M
Journal of Nanoparticle Research 15 (2013) 1723

Complexation to Ru(bpy)(2) (2+): the trick to functionalize 3,3 '-disubstituted-2,2 '-bipyridine
Guillo P, Hamelin O, Pecaut J and Menage S
Tetrahedron Letters 54 (2013) 840-842

X-ray Absorption Spectroscopy Proves the Trigonal-Planar Sulfur-Only Coordination of Copper(I) with High-Affinity Tripodal Pseudopeptides
Jullien A-S, Gateau C, Kieffer I, Testemale D and Delangle P
Inorganic Chemistry 52 (2013) 9954-9961
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Synthesis of high quality reduced graphene oxide nanosheets free of paramagnetic metallic impurities
Kumar NA, Gambarelli S, Duclairoir F, Bidan G and Dubois L
Journal of Materials Chemistry A 1 (2013) 2789-2794

Diamine Bis(phenolate) as Supporting Ligands in Organoactinide(IV) Chemistry. Synthesis, Structural Characterization, and Reactivity of Stable Dialkyl Derivatives
Mora E, Maria L, Biswas B, Camp C, Santos IC, Pecaut J, Cruz A, Carretas JM, Marcalo J and Mazzanti M
Organometallics 32 (2013) 1409-1422

Nanosilicon-Based Thick Negative Composite Electrodes for Lithium Batteries with Graphene as Conductive Additive
Nguyen BPN, Kumar NA, Gaubicher J, Duclairoir F, Brousse T, Crosnier O, Dubois L, Bidan G, Guyomard D and Lestriez B
Advanced Energy Materials 3 (2013) 1351-1357

Single Glutamate to Aspartate Mutation Makes Ferric Uptake Regulator (Fur) as Sensitive to H2O2 as Peroxide Resistance Regulator (PerR)
Parent A, Caux-Thang C, Signor L, Clemancey M, Sethu R, Blondin G, Maldivi P, Duarte V and Latour J-M
Angewandte Chemie-International Edition 52 (2013) 10339-10343

Structure and magnetism in strained Ge1-x-ySnxMny films grown on Ge(001) by low temperature molecular beam epitaxy
Prestat E, Barski A, Bellet-Amalric E, Jacquot JF, Morel R, Tainoff D, Jain A, Porret C, Bayle-Guillemaud P and Jamet M
Applied Physics Letters 103 (2013) 012403

Optimizing the relaxivity of Gd(III) complexes appended to InP/ZnS quantum dots by linker tuning
Stasiuk GJ, Tamang S, Imbert D, Gateau C, Reiss P, Fries P and Mazzanti M
Dalton Transactions 42 (2013) 8197-8200

Solid-liquid equilibria in the ternary system NaBO2-NaOH-H2O thermal behavior of double salts
Vilarinho-Franco T, Teyssier A, Tenu R, Pecaut J, Delmas J, Heitzmann M, Capron P, Counioux JJ and Goutaudier C
Fluid Phase Equilibria 360 (2013) 212-221

A Gadolinium Complex Confined in Silica Nanoparticles as a Highly Efficient T1/T2 MRI Contrast Agent
Wartenberg N, Fries P, Raccurt O, Guillermo A, Imbert D and Mazzanti M
Chemistry-a European Journal 19 (2013) 6980-6983

Multicolour Optical Coding from a Series of Luminescent Lanthanide Complexes with a Unique Antenna
Wartenberg N, Raccurt O, Bourgeat-Lami E, Imbert D and Mazzanti M
Chemistry-a European Journal 19 (2013) 3477-3482

Radioactive Europium-Chelate-Based Silica Nanoparticles as a Probe for Stability, Incorporation Efficiency and Trace Analysis
Wartenberg N, Raccurt O, Bourgeat-Lami E, Imbert D and Mazzanti M
European Journal of Inorganic Chemistry 2013 (2013) 1493-1498

Luminescent latex particles loaded with anionic lanthanide complexes: a versatile platform for multicolour optical coding
Wartenberg N, Raccurt O, Imbert D, Mazzanti M and Bourgeat-Lami E
Journal of Materials Chemistry C 1 (2013) 2061-2068

Self-Assembly Properties of Semiconducting Donor-Acceptor-Donor Bithienyl Derivatives of Tetrazine and Thiadiazole-Effect of the Electron Accepting Central Ring
Zapala J, Knor M, Jaroch T, Maranda-Niedbala A, Kurach E, Kotwica K, Nowakowski R, Djurado D, Pecaut J, Zagorska M, et al.
Langmuir 29 (2013) 14503-14511


Highly relaxing gadolinium based MRI contrast agents responsive to Mg2+ sensing
Abada S, Lecointre A, Elhabiri M, Esteban-Gomez D, Platas-Iglesias C, Tallec G, Mazzanti M, Charbonniere LJ
Chemical Communications 48 (2012) 4085-4087

Self-assembly of highly luminescent lanthanide complexes promoted by pyridine-tetrazolate ligands
Andreiadis ES, Imbert D, Pecaut J, Demadrille R, Mazzanti M
Dalton Transactions 41 (2012) 1268-1277

Metal-Controlled Diastereoselective Self-Assembly and Circularly Polarized Luminescence of a Chiral Heptanuclear Europium Wheel
Bozoklu G, Gateau C, Imbert D, Pecaut J, Robeyns K, Filinchuk Y, Memon F, Muller G, Mazzanti M
Journal of the American Chemical Society 134 (2012) 8372-8375

Multielectron redox chemistry of lanthanide Schiff-base complexes
Camp C, Guidal V, Biswas B, Pecaut J, Dubois L, Mazzanti M
Chemical Science 3 (2012) 2433-2448

Biologically Relevant Heterodinuclear Iron-Manganese Complexes
Carboni M, Clemancey M, Molton F, Pecaut J, Lebrun C, Dubois L, Blondin G, Latour JM
Inorganic Chemistry 51 (2012) 10447-10460

Magnetic communication and reactivity of a stable homometallic cation-cation trimer of pentavalent uranyl
Chatelain L, Mougel V, Pecaut J, Mazzanti M
Chemical Science 3 (2012) 1075-1079

A tetrameric neptunyl(V) cluster supported by a Schiff base ligand
Copping R, Mougel V, Den Auwer C, Berthon C, Moisy P, Mazzanti M
Dalton Transactions 41 (2012) 10900-10902

Single-ion magnet behaviour in [U(Tp(Me2))(2)I]
Coutinho JT, Antunes MA, Pereira LCJ, Bolvin H, Marcalo J, Mazzanti M, Almeida M
Dalton Transactions 41 (2012) 13568-13571

Chelation therapy in Wilson's disease: from D-penicillamine to the design of selective bioinspired intracellular Cu(I) chelators
Delangle P, Mintz E
Dalton Transactions 41 (2012) 6359-6370

Tuning of Ferromagnetic Spin Interactions in Polymeric Aromatic Amines via Modification of Their pi-Conjugated System
Dobrzynska E, Jouni M, Gawrys P, Gambarelli S, Mouesca JM, Djurado D, Dubois L, Wielgus I, Maurel V, Kulszewicz-Bajer I
Journal of Physical Chemistry B 116 (2012) 14968-14978

Computing Electronic Spin Relaxation for Gd3+-Based Contrast Agents - Practical Implementation
Fries PH
European Journal of Inorganic Chemistry 2012 (2012) 2156-2166

Model-free nuclear magnetic resonance study of intermolecular free energy landscapes in liquids with paramagnetic Ln(3+) spotlights: Theory and application to Arg-Gly-Asp
Fries PH
Journal of Chemical Physics 136 (2012) 20

Determination of the Static Zero-Field Splitting of Gd3+Complexes in Solution from the Shifts of the Central Magnetic Fields of Their EPR Spectra
Fries PH, Belorizky E
Chemphyschem 13 (2012) 2074-2081

Quantitative interpretation of the very fast electronic relaxation of most Ln(3+) ions in dissolved complexes
Fries PH, Belorizky E
Journal of Chemical Physics 136 (2012) 074513

Structural, spectroscopic and redox properties of a mononuclear Co-II thiolate complex - the reactivity toward S-alkylation: an experimental and theoretical study
Gennari M, Gerey B, Hall N, Pecaut J, Vezin H, Collomb MN, Orio M, Duboc C
Dalton Transactions 41 (2012) 12586-12594

A copper thiolate centre for electron transfer: mononuclear vs. dinuclear complexes
Gennari M, Pecaut J, Collomb MN, Duboc C
Dalton Transactions 41 (2012) 3130-3133

Effects of sputter-deposition-induced and post-deposition thermally activated intermixing on the exchange bias properties of Pt/Co (x3)/(Pt)/IrMn films
Letellier F, Baltz V, Lechevallier L, Larde R, Jacquot JF, Rodmacq B, Le Breton JM, Dieny B
Journal of Physics D-Applied Physics 45 (2012) 275001

Magnetic properties of a doped linear polyarylamine bearing a high concentration of coupled spins (S=1)
Maurel V, Jouni M, Baran P, Onofrio N, Gambarelli S, Mouesca JM, Djurado D, Dubois L, Jacquot JF, Desfonds G, Kulszewicz-Bajer I
Physical Chemistry Chemical Physics 14 (2012) 1399-1407

Siloxides as Supporting Ligands in Uranium(III)-Mediated Small-Molecule Activation
Mougel V, Camp C, Pécaut J, Copéret C, Maron L, Kefalidis CE, Mazzanti M
Angewandte Chemie-International Edition 51 (2012) 12280-12284

Uranium and manganese assembled in a wheel-shaped nanoscale single-molecule magnet with high spin-reversal barrier
Mougel V, Chatelain L, Pecaut J, Caciuffo R, Colineau E, Griveau JC, Mazzanti M
Nature Chemistry 4 (2012) 1011-1017

New polynuclear U(IV)-U(V) complexes from U(IV) mediated uranyl(V) disproportionation
Mougel V, Pecaut J, Mazzanti M
Chemical Communications 48 (2012) 868-870

Femtomolar Ln(III) Affinity in Peptide-Based Ligands Containing Unnatural Chelating Amino Acids
Niedzwiecka A, Cisnetti F, Lebrun C, Delangle P
Inorganic Chemistry 51 (2012) 5458-5464

Lanthanide-binding peptides with two pendant aminodiacetate arms: Impact of the sequence on chelation
Niedzwiecka A, Cisnetti F, Lebrun C, Gateau C, Delangle P
Dalton Transactions 41 (2012) 3239-3247

New Bisaqua Picolinate-Based Gadolinium Complexes as MRI Contrast Agents with Substantial High-Field Relaxivities
Nonat AM, Gateau C, Fries PH, Helm L, Mazzanti M
European Journal of Inorganic Chemistry 2012 (2012) 2049-2061

Iron Coordination Chemistry of N2Py2 Ligands Substituted by Carboxylic Moieties and Their Impact on Alkene Oxidation Catalysis
Oddon F, Girgenti E, Lebrun C, Marchi-Delapierre C, Pecaut J, Menage S
European Journal of Inorganic Chemistry 2012 (2012) 85-96

Modulating Uranium Binding Affinity in Engineered Calmodulin EF-Hand Peptides: Effect of Phosphorylation
Pardoux R, Sauge-Merle S, Lemaire D, Delangle P, Guilloreau L, Adriano JM, Berthomieu C
Plos One 7 (2012) e41922

A Sulfur Tripod Glycoconjugate that Releases a High-Affinity Copper Chelator in Hepatocytes
Pujol AM, Cuillel M, Jullien AS, Lebrun C, Cassio D, Mintz E, Gateau C, Delangle P
Angewandte Chemie - International Edition 51 (2012) 7445-7448

Mercury-Sequestering Pseudopeptides with a Tris(cysteine) Environment in Water
Pujol AM, Lebrun C, Gateau C, Manceau A, Delangle P
European Journal of Inorganic Chemistry 2012 (2012) 3835-3843

Crystal structure of a chiral binaphthyl porphyrin
Rose E, Raoul N, Etheve-Quelquejeu M, Gallo E, Boitrel B, Pecaut J, Dubois L
Journal of Porphyrins and Phthalocyanines 16 (2012) 324-330

Anisotropic bimodal distribution of blocking temperature with multiferroic BiFeO3 epitaxial thin films
Safeer CK, Chamfrault M, Allibe J, Carretero C, Deranlot C, Jacquet E, Jacquot JF, Bibes M, Barthelemy A, Dieny B, Bea H, Baltz V
Applied Physics Letters 100 (2012) 072402

Cu-mediated solid-state reaction in a post-functionalized metal-organic framework
Savonnet M, Canivet J, Gambarelli S, Dubois L, Bazer-Bachi D, Lecocq V, Bats N, Farrusseng D
Crystengcomm 14 (2012) 4105-4108

Rapid Natural-Abundance 2D C-13-C-13 Correlation Spectroscopy Using Dynamic Nuclear Polarization Enhanced Solid-State NMR and Matrix-Free Sample Preparation
Takahashi H, Lee D, Dubois L, Bardet M, Hediger S, De Paepe G
Angewandte Chemie-International Edition 51 (2012) 11766-11769

Seeking Hidden Magnetic Phenomena by Theoretical Means in a Thiooxoverdazyl Adduct
Verot M, Brefuel N, Pecaut J, Train C, Robert V
Chemistry-an Asian Journal 7 (2012) 380-386


Phosphorescent Binuclear Iridium Complexes Based on Terpyridine-Carboxylate: An Experimental and Theoretical Study
Andreiadis ES, Imbert D, Pecaut J, Calborean A, Ciofini I, Adamo C, Demadrille R, Mazzanti M
Inorganic Chemistry 50 (2011) 8197-8206

Characterization of Field Penetration in Superconducting Multilayers Samples
Antoine CZ, Berry S, Aurino M, Jacquot JF, Villegier JC, Lamura G, Andreone A
Ieee Transactions on Applied Superconductivity 21 (2011) 2601-2604

[U(Tp(Me2))(2)(bipy)](+): A Cationic Uranium(III) Complex with Single-Molecule-Magnet Behavior
Antunes MA, Pereira LCJ, Santos IC, Mazzanti M, Marcalo J, Almeida M
Inorganic Chemistry 50 (2011) 9915-9917

Base-Driven Assembly of Large Uranium Oxo/Hydroxo Clusters
Biswas B, Mougel V, Pecaut J, Mazzanti M
Angewandte Chemie-International Edition 50 (2011) 5744-5747

Oxidation of Zn(Cys)4 Zinc Finger Peptides by O2 and H2O2: Products, Mechanism and Kinetics
Bourles E, Isaac M, Lebrun C, Latour JM, Seneque O
Chemistry-a European Journal 17 (2011) 13762-13772

1,2-Dihydrotriazinyl-N-oxy Free Radicals
Brough P, Gambarelli S, Jacquot JF, Grand A, Pecaut J, Rey P
Chemistry-a European Journal 17 (2011) 11250-11257

A versatile precursor for non-aqueous neptunyl(V) chemistry
Copping R, Mougel V, Petit S, Den Auwer C, Moisy P, Mazzanti M
Chemical Communications 47 (2011) 5497-5499

Measurement of the Surface Recombination Velocity in Organically Functionalized Silicon Nanostructures: The Case of Silicon on Insulator
Coustel R, La Guillaume QBA, Calvo V, Renault O, Dubois L, Duclairoir F, Pauc N
Journal of Physical Chemistry C 115 (2011) 22265-22270

Magnetic field dependence of the magnetic susceptibility and the specific heat of the doped plasticized polyaniline (PANI-DB3EPSA)0.5
Djurado D, Pron A, Jacquot JF, Travers JP, Adriano C, Vargas JM, Pagliuso PG, Rettori C, Lesseux GG, Fier I, Walmsley L
Journal of Physics-Condensed Matter 23 (2011) 206004

Electrostatic immobilization of polyoxometallates on silicon: X-ray Photoelectron Spectroscopy and electrochemical studies
Fleury B, Billon M, Duclairoir F, Dubois L, Fanton A, Bidan G
Thin Solid Films 519 (2011) 3732-3738

Influence of Mixed Thiolate/Thioether versus Dithiolate Coordination on the Accessibility of the Uncommon +I and +III Oxidation States for the Nickel Ion: An Experimental and Computational Study
Gennari M, Orio M, Pecaut J, Bothe E, Neese F, Collomb MN, Duboc C
Inorganic Chemistry 50 (2011) 3707-3716

A Fully Delocalized Mixed-Valence Bis-mu(Thiolato) Dicopper Complex: A Structural and Functional Model of the Biological Cu-A Center
Gennari M, Pecaut J, DeBeer S, Neese F, Collomb MN, Duboc C
Angewandte Chemie-International Edition 50 (2011) 5661-5665

Experimental and Computational Investigation of Thiolate Alkylation in Ni(II) and Zn(II) Complexes: Role of the Metal on the Sulfur Nucleophilicity
Gennari M, Retegan M, DeBeer S, Pecaut J, Neese F, Collomb MN, Duboc C
Inorganic Chemistry 50 (2011) 10047-10055

Reversible (De)protonation-Induced Valence Inversion in Mixed-Valent Diiron(II,III) Complexes
Goure E, Thiabaud G, Carboni M, Gon N, Dubourdeaux P, Garcia-Serres R, Clemancey M, Oddou JL, Robin AY, Jacquamet L, Dubois L, Blondin G, Latour JM
Inorganic Chemistry 50 (2011) 6408-6410

Structure and magnetism of Ge3Mn5 clusters
Jain A, Jamet M, Barski A, Devillers T, Yu IS, Porret C, Bayle-Guillemaud P, Favre-Nicolin V, Gambarelli S, Maurel V, Desfonds G, Jacquot JF, Tardif S
Journal of Applied Physics 109 (2011) 013911

Half Rotations Leading to Retention of Stereochemistry in Epoxide Ring Opening by Selenocyanate Ion: Insights From DFT Modeling
Kalaiselvan A, Muthukumar K, Senthilnathan D, Maldivi P, Venuvanalingam P
International Journal of Quantum Chemistry 111 (2011) 2317-2323

Toward Reliable DFT Investigations of Mn-Porphyrins through CASPT2/DFT Comparison
Kepenekian M, Calborean A, Vetere V, Le Guennic B, Robert V, Maldivi P
Journal of Chemical Theory and Computation 7 (2011) 3532-3539

A New Route towards Redox Bistability through the Inspection of Manganese-Porphyrin Complexes
Kepenekian M, Vetere V, Le Guennic B, Maldivi P, Robert V
Chemistry-a European Journal 17 (2011) 12045-12050

Effect of substituents on redox, spectroscopic and structural properties of conjugated diaryltetrazines-a combined experimental and theoretical study
Kurach E, Djurado D, Rimarcik J, Kornet A, Wlostowski M, Lukes V, Pecaut J, Zagorska M, Pron A
Physical Chemistry Chemical Physics 13 (2011) 2690-2700

Fluorenone core donor-acceptor-donor pi-conjugated molecules end-capped with dendritic oligo(thiophene)s: synthesis, liquid crystalline behaviour, and photovoltaic applications
Lincker F, Heinrich B, De Bettignies R, Rannou P, Pecaut J, Grevin B, Pron A, Donnio B, Demadrille R
Journal of Materials Chemistry 21 (2011) 5238-5247

Uranium memory
Mazzanti M
Nature Chemistry 3 (2011) 426-427

From Atomistic to Device Level Investigation of Hybrid Redox Molecular/Silicon Field-Effect Memory Devices
Pro T, Buckley J, Barattin R, Calborean A, Aiello V, Nicotra G, Huang K, Gely M, Delapierre G, Jalaguier E, Duclairoir F, Chevalier N, Lombardo S, Maldivi P, Ghibaudo G, De Salvo B, Deleonibus S
IEEE Transactions on Nanotechnology 10 (2011) 275-283

Hepatocyte Targeting and Intracellular Copper Chelation by a Thiol-Containing Glycocyclopeptide
Pujol AM, Cuillel M, Renaudet O, Lebrun C, Charbonnier P, Cassio D, Gateau C, Dumy P, Mintz E, Delangle P
Journal of the American Chemical Society 133 (2011) 286-296

A Series of Tripodal Cysteine Derivatives as Water-Soluble Chelators that are Highly Selective for Copper(I)
Pujol AM, Gateau C, Lebrun C, Delangle P
Chemistry-a European Journal 17 (2011) 4418-4428

Cell-Permeable Ln(III) Chelate-Functionalized InP Quantum Dots As Multimodal Imaging Agents
Stasiuk GJ, Tamang S, Imbert D, Poillot C, Giardiello M, Tisseyre C, Barbier EL, Fries PH, de Waard M, Reiss P, Mazzanti M
Acs Nano 5 (2011) 8193-8201

High Relaxivity and Stability of a Hydroxyquinolinate-Based Tripodal Monoaquagadolinium Complex for Use as a Bimodal MRI/Optical Imaging Agent
Tallec G, Fries PH, Imbert D, Mazzanti M
Inorganic Chemistry 50 (2011) 7943-7945

Magnetic and conduction properties in 1D organic radical materials: an ab initio inspection for a challenging quest
Verot M, Rota JB, Kepenekian M, Le Guennic B, Robert V
Physical Chemistry Chemical Physics 13 (2011) 6657-6661


Almost Ideal 1D Water Diffusion in Imogolite Nanotubes Evidenced by NMR Relaxometry
Belorizky E, Fries PH, Guillermo A, Poncelet O
Chemphyschem 11 (2010) 2021-2026

Paramagnetic Relaxation Enhancements in Acetate and Its Fluorine Derivatives Interacting with Gd3+: Complex Formation, Structure, and Transmetallation
Bonnet CS, Fries PH
Chemphyschem 11 (2010) 3474-3484

Outer-Sphere Investigation of MRI Relaxation Contrast Agents. Example of a Cyclodecapeptide Gadolinium Complex with Second-Sphere Water
Bonnet CS, Fries PH, Crouzy S, Delangle P
Journal of Physical Chemistry B 114 (2010) 8770-8781

Diastereoselective Self-Assembly of a Homochiral Europium Triangle from a Bipyoxazoline-Carboxylate Ligand
Bozoklu G, Marchal C, Gateau C, Pecaut J, Imbert D, Mazzanti M
Chemistry-a European Journal 16 (2010) 6159-6163

Structural and photophysical properties of trianionic nine-coordinated near-IR emitting 8-hydroxyquinoline-based complexes
Bozoklu G, Marchal C, Pecaut J, Imbert D, Mazzanti M
Dalton Transactions 39 (2010) 9112-9122

Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes
Camp C, Mougel V, Horeglad P, Pecaut J, Mazzanti M
Journal of the American Chemical Society 132 (2010) 17374-17377

A structural and functional mimic of the active site of NiFe hydrogenases
Canaguier S, Field M, Oudart Y, Pecaut J, Fontecave M, Artero V
Chemical Communications 46 (2010) 5876-5878

A lanthanide binding peptide with short chelating side-chains: structural impact of the backbone coordination
Cisnetti F, Lebrun C, Delangle P
Dalton Transactions 39 (2010) 3560-3562

Sub-ppm Detection of Nerve Agents Using Chemically Functionalized Silicon Nanoribbon Field-Effect Transistors
Clavaguera S, Carella A, Caillier L, Celle C, Pecaut J, Lenfant S, Vuillaume D, Simonato JP
Angewandte Chemie-International Edition 49 (2010) 4063-4066

Stable Colloidal Solutions of High-Temperature-Annealed L1(o) FePt Nanoparticles
Delattre A, Pouget S, Jacquot JF, Samson Y, Reiss P
Small 6 (2010) 932-936

Bistable molecules development and Si surface grafting: two chemical tools used for the fabrication of hybrid molecule/Si CMOS component
Duclairoir F, Dubois L, Calborean A, Fateeva A, Fleury B, Kalaiselvan A, Marchon JC, Maldivi P, Billon M, Bidan G, de Salvo B, Delapierre G, Buckley J, Huang K, Barattin R, Pro T
International Journal of Nanotechnology 7 (2010) 719-737

Two-particle random walk simulation of outer-sphere nuclear relaxation
Fries PH
Journal of Chemical Physics 132 (2010) 224103

Enhancement of the water proton relaxivity by trapping Gd3+ complexes in nanovesicles
Fries PH, Belorizky E
Journal of Chemical Physics 133 (2010) 024504

Parallel NMR Based on Solution Magnetic-Susceptibility Differences. Application to Isotopic Effects on Self-Diffusion
Fries PH, Imbert D
Journal of Chemical and Engineering Data 55 (2010) 2048-2054

Determination of outer-sphere dipolar time correlation functions from high-field NMR measurements. Example of a Gd3+ complex in a viscous solvent
Fries PH, Imbert D, Melchior A
Journal of Chemical Physics 132 (2010) 044502

Reversible Apical Coordination of Imidazole between the Ni(III) and Ni(II) Oxidation States of a Dithiolate Complex: A Process Related to the Ni Superoxide Dismutase
Gennari M, Orio M, Pecaut J, Neese F, Collomb MN, Duboc C
Inorganic Chemistry 49 (2010) 6399-6401

Protein Tyrosine Phosphatases Are Regulated by Mononuclear Iron Dicitrate
Gomez MA, Alisaraie L, Shio MT, Berghuis AM, Lebrun C, Gautier-Luneau I, Olivier M
Journal of Biological Chemistry 285 (2010) 24620-24628

Synthesis, electrochemical and photophysical properties of heterodinuclear Ru-Mn and Ru-Zn complexes bearing ambident Schiff base ligand
Guillo P, Hamelin O, Loiseau F, Pecaut J, Menage S
Dalton Transactions 39 (2010) 5650-5657

Water-soluble tetrapodal N,O ligands incorporating soft N-heterocycles for the selective complexation of Am(III) over Ln(III)
Heitzmann M, Gateau C, Chareyre L, Miguirditchian M, Charbonnel MC, Delangle P
New Journal of Chemistry 34 (2010) 108-116

Heteroselective Polymerization of rac-Lactide in the Presence of Dialkylgallium Alkoxides: The Effect of Lewis Base on Polymerization Stereoselectivity
Horeglad P, Kruk P, Pecaut J
Organometallics 29 (2010) 3729-3734

New Insights in the Electrocatalytic Proton Reduction and Hydrogen Oxidation by Bioinspired Catalysts: A DFT Investigation
Kachmar A, Vetere V, Maldivi P, Franco AA
Journal of Physical Chemistry A 114 (2010) 11861-11867

Reliability and Storage Capacity: a Compromise Illustrated in the Two-Step Spin-Crossover System [Fe(bapbpy)(NCS)(2)]
Kepenekian M, Costa JS, Le Guennic B, Maldivi P, Bonnet S, Reedijk J, Gamez P, Robert V
Inorganic Chemistry 49 (2010) 11057-11061

New insights into the acid mediated disproportionation of pentavalent uranyl
Mougel V, Biswas B, Pecaut J, Mazzanti M
Chemical Communications 46 (2010) 8648-8650

Cation-Cation Complexes of Pentavalent Uranyl: From Disproportionation Intermediates to Stable Clusters
Mougel V, Horeglad P, Nocton G, Pecaut J, Mazzanti M
Chemistry-a European Journal 16 (2010) 14365-14377

Synthesis, Structure, and Bonding of Stable Complexes of Pentavalent Uranyl
Nocton G, Horeglad P, Vetere V, Pecaut J, Dubois L, Maldivi P, Edelstein NM, Mazzanti M
Journal of the American Chemical Society 132 (2010) 495-508

Ligand assisted cleavage of uranium oxo-clusters
Nocton G, Pecaut J, Filinchuk Y, Mazzanti M
Chemical Communications 46 (2010) 2757-2759

Improvement in gas permeability of biaxially stretched PET films blended with high barrier polymers: The role of chemistry and processing conditions
Ozen I, Bozoklu G, Dalgicdir C, Yucel O, Unsal E, Cakmak M, Menceloglu YZ
European Polymer Journal 46 (2010) 226-237

Inclusion of a Nitronyl Nitroxyl Radical and Its Hydrochloride in Cucurbit[8]uril
Peresypkina EV, Fedin VP, Maurel V, Grand A, Rey P, Vostrikova KE
Chemistry-a European Journal 16 (2010) 12481-12487

Lanthanide-chelate silica nanospheres as robust multicolor Vis-NIR tags
Samuel J, Tallec G, Cherns P, Ling WL, Raccurt O, Poncelet O, Imbert D, Mazzanti M
Chemical Communications 46 (2010) 2647-2649

Highly stable tetrathiafulvalene radical dimers in [3]catenanes
Spruell JM, Coskun A, Friedman DC, Forgan RS, Sarjeant AA, Trabolsi A, Fahrenbach AC, Barin G, Paxton WF, Dey SK, Olson MA, Benitez D, Tkatchouk E, Colvin MT, Carmielli R, Caldwell ST, Rosair GM, Hewage SG, Duclairoir F, Seymour JL, Slawin AMZ, Goddard WA, Wasielewski MR, Cooke G, Stoddart JF
Nature Chemistry 2 (2010) 870-879

Highly stable and soluble bis-aqua Gd, Nd, Yb complexes as potential bimodal MRI/NIR imaging agents
Tallec G, Imbert D, Fries PH, Mazzanti M
Dalton Transactions 39 (2010) 9490-9492

A {Cu2S}(2+) Mixed-Valent Core Featuring a Cu-Cu Bond
Torelli S, Orio M, Pecaut J, Jamet H, Le Pape L, Menage P
Angewandte Chemie-International Edition 49 (2010) 8249-8252

Modulation of the unpaired spin localization in Pentavalent Uranyl Complexes
Vetere V, Maldivi P, Mazzanti M
Comptes Rendus Chimie 13 (2010) 876-883

High energy resolution x-ray absorption spectroscopy study of uranium in varying valence states
Vitova T, Kvashnina KO, Nocton G, Sukharina G, Denecke MA, Butorin SM, Mazzanti M, Caciuffo R, Soldatov A, Behrends T, Geckeis H
Physical Review B 82 (2010) 235118


Remarkable Tuning of the Coordination and Photophysical Properties of Lanthanide Ions in a Series of Tetrazole-Based Complexes
Andreiadis ES, Demadrille R, Imbert D, Pecaut J, Mazzanti M
Chemistry-a European Journal 15 (2009) 9458-9476

A Gadolinium-Binding Cyclodecapeptide with a Large High-Field Relaxivity Involving Second-Sphere Water
Bonnet CS, Fries PH, Crouzy S, Seneque O, Cisnetti F, Boturyn D, Dumy P, Delangle P
Chemistry-a European Journal 15 (2009) 7083-7093

Cyclopentadienyl Ruthenium-Nickel Catalysts for Biomimetic Hydrogen Evolution: Electrocatalytic Properties and Mechanistic DFT Studies
Canaguier S, Vaccaro L, Artero V, Ostermann R, Pecaut J, Field MJ, Fontecave M
Chemistry-a European Journal 15 (2009) 9350-9364

Lanthanide(III) Complexes with Two Hexapeptides Incorporating Unnatural Chelating Amino Acids: Secondary Structure and Stability
Cisnetti F, Gateau C, Lebrun C, Delangle P
Chemistry-a European Journal 15 (2009) 7456-7469

Density-Functional Theory Study of the Stereochemistry of Chloroiron(III) and Chloromanganese(III) Complexes of a Bridled Chiroporphyrin
Daku LML, Castaings A, Marchon JC
Inorganic Chemistry 48 (2009) 5164-5176

Synthesis of Chiral Bridled Porphyrins in their Two Enantiomeric Forms
Fateeva A, Pecaut J, Bayle PA, Maldivi P, Dubois L
European Journal of Organic Chemistry (2009) 3845-3848

Comparison of Two Tetrapodal N,O Ligands: Impact of the Softness of the Heterocyclic N-Donors Pyridine and Pyrazine on the Selectivity for Am(III) over Eu(III)
Heitzmann M, Bravard F, Gateau C, Boubals N, Berthon C, Pecaut J, Charbonnel MC, Delangle P
Inorganic Chemistry 48 (2009) 246-256

Pentavalent uranyl stabilized by a dianionic bulky tetradentate ligand
Horeglad P, Nocton G, Filinchuk Y, Pecaut J, Mazzanti M
Chemical Communications 2009 (2009) 1843-1845

Ferrocene and Porphyrin Monolayers on Si(100) Surfaces: Preparation and Effect of Linker Length on Electron Transfer
Huang K, Duclairoir F, Pro T, Buckley J, Marchand G, Martinez E, Marchon JC, De Salvo B, Delapierre G, Vinet F
Chemphyschem 10 (2009) 963-971

Cobalt and nickel diimine-dioxime complexes as molecular electrocatalysts for hydrogen evolution with low overvoltages
Jacques PA, Artero V, Pecaut J, Fontecave M
Proceedings of the National Academy of Sciences of the United States of America 106 (2009) 20627-20632

Ligands bonded to metal ion or through-metal interacting ligands? Analysis of unusual bonds formation in the (BDTA)(2)[Co(mnt)(2)] material
Kepenekian M, Le Guennic B, Awaga K, Robert V
Physical Chemistry Chemical Physics 11 (2009) 6066-6071

Primary Role of the Electrostatic Contributions in a Rational Growth of Hysteresis Loop in Spin-Crossover Fe(II) Complexes
Kepenekian M, Le Guennic B, Robert V
Journal of the American Chemical Society 131 (2009) 11498-11502

What zeroth-order Hamiltonian for CASPT2 adiabatic energetics of Fe(II)N-6 architectures?
Kepenekian M, Robert V, Le Guennic B
Journal of Chemical Physics 131 (2009) 114702

Porphyrin anchoring on Si(100) using a beta-pyrrolic position
Liu H, Duclairoir F, Fleury B, Dubois L, Chenavier Y, Marchon JC
Dalton Transactions (2009) 3793-3799

Lanthanide-Based Coordination Polymers Assembled by a Flexible Multidentate Linker: Design, Structure, Photophysical Properties, and Dynamic Solid-State Behavior
Marchal C, Filinchuk Y, Chen XY, Imbert D, Mazzanti M
Chemistry-a European Journal 15 (2009) 5273-5288

Stable Pentavalent Uranyl Species and Selective Assembly of a Polymetallic Mixed-Valent Uranyl Complex by Cation-Cation Interactions
Mougel V, Horeglad P, Nocton G, Pecaut J, Mazzanti M
Angewandte Chemie-International Edition 48 (2009) 8477-8480

Water Stability and Luminescence of Lanthanide Complexes of Tripodal Ligands Derived from 1,4,7-Triazacyclononane: Pyridinecarboxamide versus Pyridinecarboxylate Donors
Nocton G, Nonat A, Gateau C, Mazzanti M
Helvetica Chimica Acta 92 (2009) 2257-2273

Gadolinium(III) complexes of 1,4,7-triazacyclononane based picolinate ligands: simultaneous optimization of water exchange kinetics and electronic relaxation
Nonat A, Giraud M, Gateau C, Fries PH, Helm L, Mazzanti M
Dalton Transactions (2009) 8033-8046

Structural and Photophysical Studies of Highly Stable Lanthanide Complexes of Tripodal 8-Hydroxyquinolinate Ligands Based on 1,4,7-Triazacyclononane
Nonat A, Imbert D, Pecaut J, Giraud M, Mazzanti M
Inorganic Chemistry 48 (2009) 4207-4218

Synthesis, crystal structure, magnetic properties and reactivity of a Ni-Ru model of NiFe hydrogenases with a pentacoordinated triplet (S=1) Ni(II) center
Oudart Y, Artero V, Norel L, Train C, Pecaut J, Fontecave M
Journal of Organometallic Chemistry 694 (2009) 2866-2869

Investigation of Hybrid Molecular/Silicon Memories With Redox-Active Molecules Acting as Storage Media
Pro T, Buckley J, Huang K, Calborean A, Gely M, Delapierre G, Ghibaudo G, Duclairoir F, Marchon JC, Jalaguier E, Maldivi P, De Salvo B, Deleonibus S
Ieee Transactions on Nanotechnology 8 (2009) 204-213

A Cysteine-Based Tripodal Chelator with a High Affinity and Selectivity for Copper(I)
Pujol AM, Gateau C, Lebrun C, Delangle P
Journal of the American Chemical Society 131 (2009) 6928-6929

Analysis of the First Bridge Diagram of Liquid Bromine
Rast S, Fries PH, Krienke H
Acta Chimica Slovenica 56 (2009) 180-187

Covalent vs Electrostatic Interactions in Rare Earth Systems: A Comparative Study of U(III), U(IV), and U(V) and Nd(III) Bonding Properties by DFT and CAS-PT2 Approaches
Vetere V, Maldivi P, Roos BO, Adamo C
Journal of Physical Chemistry A 113 (2009) 14760-14765


1D and 2D Fe-II azide coordination polymers with ferromagnetic canting
Abu-Youssef MAM, Langer V, Luneau D, Shams E, Goher MAS, Ohrstrom L
European Journal of Inorganic Chemistry 2008 (2008) 112-118

Investigations on the fluorescence quenching of 2,3-diazabicyclo[2.2.2]oct-2-ene by certain flavonoids
Anbazhagan V, Kalaiselvan A, Jaccob M, Venuvanalingam P, Renganathan R
Journal of Photochemistry and Photobiology B-Biology 91 (2008) 143-150

Multiple aromatic amination mediated by a diiron complex
Avenier F, Goure E, Dubourdeaux P, Seneque O, Oddou JL, Pecaut J, Chardon-Noblat S, Deronzier A, Latour JM
Angewandte Chemie-International Edition 47 (2008) 715-717

Comparison of different methods for calculating the paramagnetic relaxation enhancement of nuclear spins as a function of the magnetic field
Belorizky E, Fries PH, Helm L, Kowalewski J, Kruk D, Sharp RR, Westlund PO
Journal of Chemical Physics 128 (2008) 052315

A rigorous framework to interpret water relaxivity. The case study of a Gd(III) complex with an alpha-cyclodextrin derivative
Bonnet CS, Fries PH, Gadelle A, Gambarelli S, Delangle P
Journal of the American Chemical Society 130 (2008) 10401-10413

A flexible tripodal ligand linking octametallic terbium rings into luminescent polymeric chains
Chen XY, Marchal C, Filinchuk Y, Imbert D, Mazzanti M
Chemical Communications 2008 (2008) 3378-3380

Definition of magneto-structural correlations for the Mn-II ion
Duboc C, Collomb MN, Pecaut J, Deronzier A, Neese F
Chemistry-a European Journal 14 (2008) 6498-6509

Carboxylate Ligands drastically enhance the rates of oxo exchange and hydrogen peroxide disproportionation by oxo manganese compounds of potential biological significance
Dubois L, Pecaut J, Charlot MF, Baffert C, Collomb MN, Deronzier A, Latour JM
Chemistry-a European Journal 14 (2008) 3013-3025

Synthesis and conformational studies of chiral meso-(alpha, beta-unsaturated)-porphyrins
Fateeva A, Calborean A, Pecaut J, Maldivi P, Marchon JC, Dubois L
Tetrahedron 64 (2008) 10874-10881

Determination of the rate of a fast exchanging coordinated molecule in a lanthanide(III) complex by proton NMR
Fries PH, Giraud M, Belorizky E
Physical Chemistry Chemical Physics 10 (2008) 5817-5821

Synthesis and solid-state NMR study of chromium complexes of per(3,6-anhydro)-alpha-cyclodextrin based polymers
Gerbaud G, Hediger S, Gadelle A, Bardet M
Carbohydrate Polymers 73 (2008) 64-73

Efficient sensitization of lanthanide luminescence by tetrazole-based polydentate ligands
Giraud M, Andreiadis ES, Fisyuk AS, Demadrille R, Pecaut J, Imbert D, Mazzanti M
Inorganic Chemistry 47 (2008) 3952-3954

New polydentate ligand and catalytic properties of the corresponding ruthenium complex during sulfoxidation and alkene epoxidation
Hamelin O, Menage S, Charnay F, Chavarot M, Pierre JL, Pecaut J, Fontecave M
Inorganic Chemistry 47 (2008) 6413-6420

Cerebral blood volume quantification in a C6 tumor model using gadolinium per (3,6-anhydro) alpha-cyclodextrin as a new magnetic resonance imaging preclinical contrast agent
Lahrech H, Perles-Barbacaru AT, Aous S, Le Bas JF, Debouzy JC, Gadelle A, Fries PH
Journal of Cerebral Blood Flow and Metabolism 28 (2008) 1017-1029

Molecular magnets based on two-dimensional Mn(II)-nitronyl nitroxide frameworks in layered structures
Luneau D, Borta A, Chumakov Y, Jacquot JF, Jeanneau E, Lescop C, Rey P
Inorganica Chimica Acta 361 (2008) 3669-3676

Polynuclear Cation-Cation Complexes of Pentavalent Uranyl: Relating Stability and Magnetic Properties to Structure
Nocton G, Horeglad P, Pecaut J, Mazzanti M
Journal of the American Chemical Society 130 (2008) 16633-16645

A nitrido-centered uranium azido cluster obtained from a uranium azide
Nocton G, Pecaut J, Mazzanti M
Angewandte Chemie-International Edition 47 (2008) 3040-3042

Ab initio molecular dynamics study of a highly concentrated LiCl aqueous solution
Petit L, Vuilleumier R, Maldivi P, Adamo C
Journal of Chemical Theory and Computation 4 (2008) 1040-1048

Molecular dynamics study of the coordination sphere of trivalent lanthanum in a highly concentrated LiCl aqueous solution: A combined classical and ab initio approach
Petit L, Vuilleumier R, Maldivi P, Adamo C
Journal of Physical Chemistry B 112 (2008) 10603-10607

Interplay between glutathione, Atx1 and copper: X-ray absorption spectroscopy determination of Cu(I) environment in an Atx1 dimer
Poger D, Fillaux C, Miras R, Crouzy S, Delangle P, Mintz E, Den Auwer C, Ferrand M
Journal of Biological Inorganic Chemistry 13 (2008) 1239-1248


Investigation with C-13 NMR, EPR and magnetic susceptibility measurements of char residues obtained by pyrolysis of biomass
Bardet M, Hediger S, Gerbaud G, Gambarelli S, Jacquot JF, Foray MF, Gadelle A
Fuel 86 (2007) 1966-1976

Multiple-frequency EPR spectra of two aqueous Gd3+ polyamino polypyridine carboxylate complexes: A study of high field effects
Borel A, Laus S, Ozarowski A, Gateau C, Nonat A, Mazzanti M, Helm L
Journal of Physical Chemistry A 111 (2007) 5399-5407

Selective self-assembly of hexameric homo- and heteropolymetallic lanthanide wheels: Synthesis, structure, and photophysical studies
Chen XY, Bretonniere Y, Pecaut J, Imbert D, Bunzli JC, Mazzanti M
Inorganic Chemistry 46 (2007) 625-637

Redox-induced mu-acetato and mu-oxo core interconversions in dinuclear manganese tris(2-methylpyridyl)amine (tpa) complexes: Isolation and characterization of [Mn-2(III)(mu-O)(mu-O2CCH3)(tpa)(2)](3+)
Collomb MN, Mantel C, Romain S, Duboc C, Lepretre JC, Pecaut J, Deronzier A
European Journal of Inorganic Chemistry 2007 (2007) 3179-3187

Hexakis (3,6-anhydro)-tetrakis [2(I,II,IV,V)-O-(2-ethoxyethyl)] derivatives of (3,6-anhydro)-alpha-cyclodextrin exhibits novel cation affinities and tensioactive properties on membranes
Debouzy JC, Crouzier D, Gadelle A
Pharmazie 62 (2007) 892-899

A comparative spectroscopic study of U(III)/Am(III) and Ln(III) complexed with N-donor ligands
Denecke MA, Panak PJ, Burdet F, Weigl M, Geist A, Klenze R, Mazzanti M, Gompper K
Comptes Rendus Chimie 10 (2007) 872-882

High-field EPR investigation of a series of mononuclear Mn(II) complexes doped into Zn(II) hosts
Duboc C, Phoeung T, Jouvenot D, Blackman AG, McClintock LF, Pecaut J, Deronzier A, Collomb MN
Polyhedron 26 (2007) 5243-5249

Origin of the zero-field splitting in mononuclear octahedral dihalide Mn-II complexes: An investigation by multifrequency high-field electron paramagnetic resonance and density functional theory
Duboc C, Phoeung T, Zein S, Pecaut J, Collomb MN, Neese F
Inorganic Chemistry 46 (2007) 4905-4916

Non-cytotoxic, bifunctional Eu-III and Tb-III luminescent macrocyclic complexes for luminescence resonant energy-transfer experiments
Ferrand AC, Imbert D, Chauvin AS, Vandevyver CDB, Bunzli JCG
Chemistry-a European Journal 13 (2007) 8678-8687

Relaxation theory of the electronic spin of a complexed paramagnetic metal ion in solution beyond the Redfield limit
Fries PH, Belorizky E
Journal of Chemical Physics 126 (2007) 204503

Chiral-at-metal ruthenium complex as a metalloligand for asymmetric catalysis
Hamelin O, Rimboud M, Pecaut J, Fontecave M
Inorganic Chemistry 46 (2007) 5354-5360

New spin-transition-like copper(II)-nitroxide species
Hirel C, Li L, Brough P, Vostrikova K, Pecaut J, Mehdaoui B, Bernard M, Turek P, Rey P
Inorganic Chemistry 46 (2007) 7545-7552

Theoretical description of metal-ligand bonding within f-element complexes: A successful and necessary interplay between theory and experiment
Maldivi P, Petit L, Adamo C, Vetere V
Comptes Rendus Chimie 10 (2007) 888-896

Toward the rational design of lanthanide coordination polymers: A new topological approach
Marchal C, Filinchuk Y, Imbert D, Bunzli JCG, Mazzanti M
Inorganic Chemistry 46 (2007) 6242-6244

H-1 and Xe-129 NMR absorption line shapes in the presence of highly polarized and concentrated xenon solutions in high magnetic field
Marion DJY, Huber G, Dubois L, Berthault P, Desvaux H
Journal of Magnetic Resonance 187 (2007) 78-87

Self-assembly of polyoxo clusters and extended frameworks by controlled hydrolysis of low-valent uranium
Nocton G, Burdet F, Pecaut J, Mazzanti M
Angewandte Chemie-International Edition 46 (2007) 7574-7578

Structure, stability, dynamics, high-field relaxivity and ternary-complex formation of a new tris(aquo) gadolinium complex
Nonat A, Fries PH, Pecaut J, Mazzanti M
Chemistry-a European Journal 13 (2007) 8489-8506

Dinuclear nickel-ruthenium complexes as functional bio-inspired models of [NiFe] hydrogenases
Oudart Y, Artero V, Pecaut J, Lebrun C, Fontecave M
European Journal of Inorganic Chemistry 2007 (2007) 2613-2626

Relating structural and thermodynamic effects of the Pb(II) lone pair: A new picolinate ligand designed to accommodate the Pb(II) lone pair leads to high stability and selectivity
Pellissier A, Bretonniere Y, Chatterton N, Pecaut J, Delangle P, Mazzanti M
Inorganic Chemistry 46 (2007) 3714-3725

DFT modeling of the relative affinity of nitrogen ligands for trivalent f elements: an energetic point of view
Petit L, Daul C, AdaMob C, Maldivi P
New Journal of Chemistry 31 (2007) 1738-1745

Tricarbonylmanganese(I)-lysozyme complex: a structurally characterized organometallic protein
Razavet M, Artero V, Cavazza C, Oudart Y, Lebrun C, Fontecilla-Camps JC, Fontecave M
Chemical Communications (2007) 2805-2807

Synthesis and structure elucidation of large phosphorus macrocycles
Tinant B, Delangle P, Mulatier JC, Declercq JP, Dutasta JP
Journal of Inclusion Phenomena and Macrocyclic Chemistry 58 (2007) 139-149


Investigation of the structures of the crystalline and columnar phases of linear chain copper(II) alkanoates
Abied H, Guillon D, Skoulios A, Weber P, Giroud-Godquin AM, Marchon JC
Liquid Crystals 33 (2006) 1249-1254

A nonanuclear dysprosium (III)-copper(II) complex exhibiting single-molecule magnet behavior with very slow zero-field relaxation
Aronica C, Pilet G, Chastanet G, Wernsdorfer W, Jacquot JF, Luneau D
Angewandte Chemie-International Edition 45 (2006) 4659-4662

Variable temperature and EPR frequency study of two aqueous Gd(III) complexes with unprecedented sharp lines
Borel A, Kang H, Gateau C, Mazzanti M, Clarkson RB, Belford RL
Journal of Physical Chemistry A 110 (2006) 12434-12438

Pyrimidinyl nitronyl nitroxides
Brough P, Pecaut J, Rassat A, Rey P
Chemistry-a European Journal 12 (2006) 5134-5141

Electrochemical synthesis of cyclopyrrole
Bucher C, Devillers CH, Moutet JC, Pecaut J, Sessler JL
Chemical Communications (2006) 3891-3893

Isolation of a tetrameric cation-cation complex of pentavalent uranyl
Burdet F, Pecaut J, Mazzanti M
Journal of the American Chemical Society 128 (2006) 16512-16513

Infrared spectral study of bistable chiral porphyrins
Castaings A, Pecaut J, Marchon JC
Comptes Rendus Chimie 9 (2006) 1163-1168

A multifrequency high-field EPR (9-285 GHz) investigation of a series of dichloride mononuclear penta-coordinated Mn(II) complexes
Duboc C, Astier-Perret V, Chen HY, Pecaut J, Crabtree RH, Brudvig GW, Collomb MN
Inorganica Chimica Acta 359 (2006) 1541-1548

X-Ray photoreduction of a di(mu-oxo)(MnMnIV)-Mn-III complex occurs at temperatures as low as 20 K
Dubois L, Jacquamet L, Pecaut J, Latour JM
Chemical Communications (2006) 4521-4523

Synthesis, structure, and spectroscopic and magnetic properties of mesomorphic octakis(hexylthio)-substituted phthalocyanine rare-earth metal sandwich complexes
Gurek AG, Basova T, Luneau D, Lebrun C, Kol'tsov E, Hassan AK, Ahsen V
Inorganic Chemistry 45 (2006) 1667-1676

Electrochemical signature of the coordination mode in metal complexes with a tris-ferrocenyl derivative of the Taci ligand
Heitzmann M, Bucher C, Moutet JC, Royal G, Saint-Aman E, Gateau C, Lebrun C, Delangle P
Supramolecular Chemistry 18 (2006) 13-21

Water soluble cryptophanes showing unprecedented affinity for xenon: Candidates as NMR-based biosensors
Huber G, Brotin T, Dubois L, Desvaux H, Dutasta JP, Berthault P
Journal of the American Chemical Society 128 (2006) 6239-6246

Chiroptical and computational studies of a bridled chiroporphyrin and of its nickel(II), copper(II), and zinc(II) complexes
Maheut G, Castaings A, Pecaut J, Daku LML, Pescitelli G, Di Bari L, Marchon JC
Journal of the American Chemical Society 128 (2006) 6347-6356

Novel thermostable Y-family polymerases: applications for the PCR amplification of damaged or ancient DNAs
McDonald JP, Hall A, Gasparutto D, Cadet J, Ballantyne J, Woodgate R
Nucleic Acids Research 34 (2006) 1102-1111

Local diffusion in paramagnetic solutions by NMR relaxometry at one frequency
Melchior A, Fries PH
Journal of the American Chemical Society 128 (2006) 7424-7425

Synthesis and structure of a stable pentavalent-uranyl coordination polymer
Natrajan L, Burdet F, Pecaut J, Mazzanti M
Journal of the American Chemical Society 128 (2006) 7152-7153

Fixation of atmospheric CO2 by a dimeric lanthanum hydroxide complex; assembly of an unusual hexameric carbonate
Natrajan L, Pecaut J, Mazzanti M
Dalton Transactions (2006) 1002-1005

Lanthanide complexes of a picolinate ligand derived from 1,4,7-triazacyclononane with potential application in magnetic resonance imaging and time-resolved luminescence imaging
Nonat A, Gateau C, Fries PH, Mazzanti M
Chemistry-a European Journal 12 (2006) 7133-7150

Ni(xbsms)Ru(CO)(2)Cl-2]: A bioinspired nickel-ruthenium functional model of [NiFe] hydrogenase
Oudart Y, Artero V, Pecaut J, Fontecave M
Inorganic Chemistry 45 (2006) 4334-4336

Toward a clear-cut vision on the origin of 2,6-di(1,2,4-triazin-3-yl)pyridine selectivity for trivalent actinides: Insights from theory
Petit L, Adamo C, Maldivi P
Inorganic Chemistry 45 (2006) 8517-8522

A theoretical characterization of covalency in rare earth complexes through their absorption electronic properties: f-f transitions
Petit L, Borel A, Daul C, Maldivi P, Adamo C
Inorganic Chemistry 45 (2006) 7382-7388

A comprehensive theoretical view of the bonding in actinide molecular complexes
Petit L, Joubert L, Maldivi P, Adamo C
Journal of the American Chemical Society 128 (2006) 2190-2191

Model peptides based on the binding loop of the copper metallochaperone Atx1: Selectivity of the consensus sequence MxCxxC for metal ions Hg(II), Cu(I), Cd(II), Pb(II), and Zn(II)
Rousselot-Pailley P, Seneque O, Lebrun C, Crouzy S, Boturyn D, Dumy P, Ferrand M, Delangle P
Inorganic Chemistry 45 (2006) 5510-5520


Inclusion complexes of trivalent lutetium cations with an acidic derivative of per(3,6-anhydro)-alpha-cyclodextrin
Bonnet C, Gadelle A, Pecaut J, Fries PH, Delangle P
Chemical Communications (2005) 625-627

Calix[4]phyrin based redox architectures: towards new molecular tools for electrochemical sensing
Bucher C, Devillers CH, Moutet JC, Pecaut J, Royal G, Saint-Aman E, Thomas F
Dalton Transactions (2005) 3620-3631

An efficient design for the rigid assembly of four bidentate chromophores in water-stable highly luminescent lanthanide complexes
Chatterton N, Bretonniere Y, Pecaut J, Mazzanti M
Angewandte Chemie-International Edition 44 (2005) 7595-7598

The effect of pyridinecarboxylate chelating groups on the stability and electronic relaxation of gadolinium complexes
Chatterton N, Gateau C, Mazzanti M, Pecaut J, Borel A, Helm L, Merbach A
Dalton Transactions (2005) 1129-1135

Tetranuclear manganese(II) complexes of thiacalixarene macrocycles with trigonal prismatic six-coordinate geometries: Synthesis, structure, and magnetic properties
Desroches C, Pilet G, Borshch SA, Parola S, Luneau D
Inorganic Chemistry 44 (2005) 9112-9120

Electronic relaxation of paramagnetic metal ions and NMR relaxivity in solution: Critical analysis of various approaches and application to a Gd(III)-based contrast agent
Fries PH, Belorizky E
Journal of Chemical Physics 123 (2005) 124510

Practical route to relative diffusion coefficients and electronic relaxation rates of paramagnetic metal complexes in solution by model-independent outer-sphere NMRD. Potentiality for MRI contrast agents
Fries PH, Gateau C, Mazzanti M
Journal of the American Chemical Society 127 (2005) 15801-15814

New trends in the chemistry of iron(III) citrate complexes: Correlations between X-ray structures and solution species probed by electrospray mass spectrometry and kinetics of iron uptake from citrate by iron chelators
Gautier-Luneau I, Merle C, Phanon D, Lebrun C, Biaso F, Serratrice G, Pierre JL
Chemistry-a European Journal 11 (2005) 2207-2219

Enantiopure and racemic chiral nitronyl nitroxide free radicals: Synthesis and characterization
Hirel C, Pecaut J, Choua S, Turek P, Amabilino DB, Veciana J, Rey P
European Journal of Organic Chemistry (2005) 348-359

Magnetism of metal-nitroxide compounds involving bis-chelating imidazole and benzimidazole substituted nitronyl nitroxide free radicals
Luneau D, Rey P
Coordination Chemistry Reviews 249 (2005) 2591-2611

High-spin chloro mononuclear Mn-III complexes: A multifrequency high-field EPR study
Mantell C, Chen HY, Crabtree RH, Brudvig GW, Pecaut J, Collomb MN, Duboc C
Chemphyschem 6 (2005) 541-546

Practical synthetic routes to solvates of U(OTf)(3): X-ray crystal structure of [U(OTf)(3)(MeCN)(3)](n), a unique U(III) coordination polymer
Natrajan L, Mazzanti M, Bezombes JP, Pecaut J
Inorganic Chemistry 44 (2005) 6115-6121

Controlled hydrolysis of lanthanide complexes of the N-donor tripod tris(2-pyridylmethyl)amine versus bisligand complex formation
Natrajan L, Pecaut J, Mazzanti M, LeBrun C
Inorganic Chemistry 44 (2005) 4756-4765

Hexakis (3,6-anhydro) tetrakis (2(A,B,D,E)-O-butyl) cyclomalto hexaose as a promising biological cation cryptant: complexation and NMR study of interaction with membranes
Pailler JY, Gadelle A, Debouzy JC
Journal of Drug Delivery Science and Technology 15 (2005) 237-244

Predictions of optical excitations in transition-metal complexes with time dependent-density functional theory: Influence of basis sets
Petit L, Maldivi P, Adamo C
Journal of Chemical Theory and Computation 1 (2005) 953-962

Fast hybrid methods for the simulation of dielectric constants of liquids
Richardi J, Fries PH, Millot C
Journal of Molecular Liquids 117 (2005) 3-16

Activation of oxaziridines by Lewis acids: Application in enantioselective sulfoxidation
Schoumacker S, Hamelin O, Teti S, Pecaut J, Fontecave M
Journal of Organic Chemistry 70 (2005) 301-308

Energetics and structural consequences of axial ligand coordination in nonplanar nickel porphyrins
Song YJ, Haddad RE, Jia SL, Hok S, Olmstead MM, Nurco DJ, Schore NE, Zhang J, Ma JG, Smith KM et al.
Journal of the American Chemical Society 127 (2005) 1179-1192

Synthesis and solvent effects on the spectroscopic properties of octatosylamido phthalocyanines
Yuksel F, Gurek AG, Lebrun C, Ahsen V
New Journal of Chemistry 29 (2005) 726-732