Publications
2014
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Scandium Carbene Complexes: Synthesis of Mixed Alkyl, Amido, and Phosphido Derivatives
- Fustier Marie
- Le Goff X. F
- Lutz Martin
- Slootweg J. Chris
- Mézailles Nicolas
DOI : 10.1021/om500868a -
Le millefeuille des affiliations françaises dans les publications scientifiques
- Dassa Michèle
- Deniau Alina
- Durand-Barthez Manuel
- Girard Françoise
- Pothier Nathalie
- Séné Angèle
DOI : 10.3917/docsi.514.0012 -
Structure and Thermodynamics of Mg:Phosphate Interactions in Water: A Simulation Study
- Kumar Manjeet
- Simonson Thomas
- Ohanessian Gilles
- Clavaguéra Carine
DOI : 10.1002/cphc.201402685 -
Ultraviolet–vis degradation of iprodione and estimation of the acute toxicity of its photodegradation products
- Lassalle Yannick
- Jellouli Héla
- Ballerini Laurie
- Souissi Yasmine
- Nicol Edith
- Bourcier Sophie
- Bouchonnet Stéphane
DOI : 10.1016/j.chroma.2014.10.051 -
Interactions non-covalentes et propriétés physico-chimiques de petits systèmes biologiques : approches théoriques
- Riffet Vanessa
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To Bend or Not To Bend: Experimental and Computational Studies of Structural Preference in Ln(Tp iPr 2 ) 2 (Ln = Sm, Tm)
- Momin Aurélien
- Carter Lee
- Yang Yi
- Mcdonald Robert
- Essafi (née Labouille) Stéphanie
- Nief François
- Del rosal Iker
- Sella Andrea
- Maron Laurent
- Takats Josef
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Planar Chiral Phosphoric Acids with Biphenylene-Tethered Paracyclophane Scaffolds: Synthesis, Characterization, and Catalytic Screening
- Isaac Kevin
- Stemper Jérémy
- Servajean Vincent
- Retailleau Pascal ́
- Pastor Julien
- Frison Gilles
- Kaupmees Karl
- Leito Ivo
- Betzer Jean-François
- Marinetti Angela
DOI : 10.1021/jo501769t -
Reductive Alkylation of Thioamides with Grignard Reagents in the Presence of Ti(OiPr)4: Insight and Extension
- Hermant Fabien
- Urbańska Ewelina
- Seizilles de Mazancourt Sarah
- Maubert Thomas
- Nicolas Emmanuel
- Six Yvan
DOI : 10.1021/om500603v -
Apport de la modélisation en organocatalyse : sélectivités, mécanismes et propriétés.
- Pastor Julien
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Modelling the structure and IR spectra of micro-hydrated ions
- Jana Chandramohan
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Versatile coordination chemistry of a bis(methyliminophosphoranyl)pyridine ligand on copper centres
- Cheisson Thibault
- Auffrant Audrey
DOI : 10.1039/C4DT01794C -
Recent Advances in Electrophilic Amination Reactions
- Corpet Martin
- Gosmini Corinne
DOI : 10.1055/s-0034-1378373 -
Multiple One-Electron Transfers in Bipyridine Complexes of Bis(phospholyl) Thulium
- Jacquot Léa
- Xemard Mathieu
- Clavaguera Carine
- Nocton Grégory
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Ti(OiPr)(4)/nBuLi: an attractive reagent system for [2+2+2] cyclotrimerisation reactions
- Rassadin Valentin A.
- Nicolas E.
- Six Yvan
DOI : 10.1039/C4CC02698E -
Ti-mediated intramolecular cyclopropanation of N-alkenyl thioamides: scope and mechanistic study
- Hermant Fabien
- Nicolas Emmanuel
- Six Yvan
DOI : 10.1016/j.tet.2014.04.006 -
Nickel Complexes Featuring Iminophosphorane–Phenoxide Ligands for Catalytic Ethylene Dimerization
- Cheisson Thibault
- Cao Thi-Phuong-Anh
- Le Goff X. F
- Auffrant Audrey
DOI : 10.1021/om500880g -
Copper-Catalyzed Coupling of N-Tosylhydrazones with Amines: Synthesis of Fluorene Derivatives
- Aziz Jessy
- Frison Gilles
- Gomez Montserrat
- Brion Jean-Daniel
- Hamze Abdallah
- Alami Mouad
DOI : 10.1021/cs5014877 -
Finite Temperature Infrared Spectra from Polarizable Molecular Dynamics Simulations
- Semrouni David
- Sharma Ashwani
- Dognon Jean-Pierre
- Ohanessian Gilles
- Clavaguéra Carine
DOI : 10.1021/ct5004065 -
Titanium imido complexes stabilised by bis(iminophosphoranyl)methanide ligands: the influence of N-substituents on solution dynamics and reactivity
- Normand Adrien T.
- Massard Alexandre
- Richard Philippe
- Canovas Coline
- Balan Cédric
- Picquet Michel
- Auffrant Audrey
- Le Gendre Pierre
DOI : 10.1039/C4DT00746H -
Benchmarking DFT and TD-DFT functionals for the ground and excited states of hydrogen-rich peptide radicals
- Riffet Vanessa
- Jacquemin Denis
- Cauet Emilie
- Frison Gilles
DOI : 10.1021/ct5004912 -
Accuracy of density functionals in the description of dispersion interactions and IR spectra of phosphates and phosphorylated compounds
- Sharma Ashwani
- Ohanessian Gilles
- Clavaguera Carine
DOI : 10.1007/s00894-014-2426-y -
Vibrational Signatures of S-Nitroso Glutathione as Gaseous, Protonated Species
- Gregori Barbara
- Guidoni Leonardo
- Chiavarino Barbara
- Scuderi Debora
- Nicol Edith
- Frison Gilles
- Fornarini Simonetta
- Crestoni Maria Elisa
DOI : 10.1021/jp5072742 -
Hydration gibbs free energies of open and closed shell trivalent lanthanide and actinide cations from polarizable molecular dynamics
- Marjolin Aude
- Gourlaouen Christophe
- Clavaguéra Carine
- Ren Pengyu Y.
- Piquemal Jean-Philip
- Dognon Jean-Pierre
DOI : 10.1007/s00894-014-2471-6 -
Reversible Sigma C-C Bond Formation Between Phenanthroline Ligands Activated by (C5Me5)2Yb
- Nocton Grégory A
- Lukens Wayne A
- Booth Corwin A
- Rozenel Sergio A
- Medling Scott A
- Maron Laurent
- Andersen Richard A
DOI : 10.1021/ja502271q -
Pincer versus Pseudo-Pincer: Isomerism in Palladium(II) Complexes bearing κ3C,S,C ligands
- Bernhammer Jan C.
- Frison Gilles
- Huynh Han Vinh
DOI : 10.1039/C4DT01047G