Département de chimie moléculaire

Reduction of Water to H2 by Diorganopalladium(II) Complexes of Tris(pyrazol-1-yl)borate: Ab-Initio Theoretical Study of the Mechanism., Milet, Anne, Dedieu Alain, and Canty Allan J. , Organometallics, Volume 16, Number 24, p.5331–5341, (1997)

Regiochemistry in the Pauson-Khand Reaction: Has a Trans Effect Been Overlooked?., Robert, Frederic, Milet Anne, Gimbert Yves, Konya Denes, and Greene Andrew E. , J. Am. Chem. Soc., Volume 123, Number 23, p.5396–5400, (2001)

Response to Comment on Autoionization at the surface of neat water: is the top layer pH neutral, basic, or acidic? by J. K. Beattie, Phys. Chem. Chem. Phys., 2007, 9, DOI: 10.1039/b713702h., Vacha, Robert, Buch Victoria, Milet Anne, J Devlin Paul, and Jungwirth Pavel. , Phys. Chem. Chem. Phys., Volume 10, Number 2, p.332–333, (2008)

Reversible dimerization of viologen radicals covalently linked to a calixarene platform: Experimental and theoretical aspects., Kahlfuss, Christophe, Metay Estelle, Duclos Marie-Christine, Lemaire Marc, Oltean Mircea, Milet Anne, Saint-Aman Eric, and Bucher Christophe , Comptes Rendus Chim., Volume 17, Number 6, p.505–511, (2014)

Role of cancellation of errors in ab initio calculations: Structure and energetics of the OH- (H2O) system and electric dipole properties of the subsystems. [Erratum to document cited in CA138:45026]., Weck, Gaetan, Milet Anne, Moszynski Robert, and Kochanski Elise. , J. Phys. Chem. A, Volume 107, Number 19, p.4008, (2003)

Role of Cancellation of Errors in Ab Initio Calculations: Structure and Energetics of the OH- (H2O) System and Electric Dipole Properties of the Subsystems., Weck, Gaetan, Milet Anne, Moszynski Robert, and Kochanski Elise. , J. Phys. Chem. A, Volume 106, Number 50, p.12084–12094, (2002)

Silver versus gold catalysis in tandem reactions of carbonyl functions onto alkynes: a versatile access to furoquinoline and pyranoquinoline cores., Godet, Thomas, Vaxelaire Carine, Michel Carine, Milet Anne, and Belmont Philippe. , Chem. - A Eur. J., Volume 13, Number 19, p.5632–5641, S5632/1–S5632/46, (2007)

Structural, kinetic, and theoretical studies on models of the zinc-containing phosphodiesterase active center: medium-dependent reaction mechanisms., Selmeczi, Katalin, Michel Carine, Milet Anne, Gautier-Luneau Isabelle, Philouze Christian, Pierre Jean-Louis, Schnieders David, Rompel Annette, and Belle Catherine , Chem. - A Eur. J., Volume 13, Number 32, p.9093–9106, (2007)

Synthesis and Theoretical Studies of a Diorganohydridoplatinum(IV) Complex, PtHMe2\(pz)3BH-N,N',N''\} ([(pz)3BH]- = Tris(pyrazol-1-yl)borate).}, Canty, Allan J., Dedieu Alain, Jin Hong, Milet Anne, and Richmond Matthew K. , Organometallics, Volume 15, Number 12, p.2845–2847, (1996)

Synthesis of N-acridinyl-N'-alkylguanidines: Dramatic influence of amine to guanidine replacement on the physicochemical properties., Zeghida, Walid, Debray Julien, Michel Carine, Milet Anne, Dumy Pascal, and Demeunynck Martine , Bioorg. Med. Chem. Lett., Volume 18, Number 17, p.4779–4782, (2008)

Theoretical Study of the Addition of Hydrogen Cyanide to Methanimine in the Gas Phase and in Aqueous Solution., Arnaud, Roger, Adamo Carlo, Cossi Maurizio, Milet Anne, Vallee Yannick., and Barone Vincenzo. , J. Am. Chem. Soc., Volume 122, Number 2, p.324–330, (2000)

Theoretical study of the hydrogen chloride trihydrate., Struniewicz, Cezary, Milet Anne, Sadlej Joanna, and Moszynski Robert. , Int. J. Quantum Chem., Volume 90, Number 3, p.1151–1162, (2002)

Theoretical Study of the Regiochemistry-Determining Step of the Pauson-Khand Reaction., de Bruin, Theodorus J. M., Milet Anne, Robert Frederic, Gimbert Yves, and Greene Andrew E. , J. Am. Chem. Soc., Volume 123, Number 29, p.7184–7185, (2001)

Theoretical Study, Synthesis, and Reactivity of Five-Membered-Ring Acyl Sulfonium Cations., Rao, K V. Raghaven, Caiveau Nicolas, David Rolf, Shalayel Ibrahim, Milet Anne, and Vallee Yannick. , Eur. J. Org. Chem., Volume 2015, Number 28, p.6125–6129, (2015)

Tracing the Entropy along a Reactive Pathway: The Energy As a Generalized Reaction Coordinate., Michel, Carine, Laio Alessandro, and Milet Anne , J. Chem. Theory Comput., Volume 5, Number 9, p.2193–2196, (2009)

Viologen-based redox-switchable anion-binding receptors., Kannappan, Ramu, Bucher Christophe, Saint-Aman Eric, Moutet Jean-Claude, Milet Anne, Oltean Mircea, Metay Estelle, Pellet-Rostaing Stephane, Lemaire Marc, and Chaix Carole. , New J. Chem., Volume 34, Number 7, p.1373–1386, (2010)

Was methionine the molecular trigger of life on early earth?., Vallee, Yannick., Milet Anne, and Rao K V. Raghaven , Phosphorus, Sulfur Silicon Relat. Elem., Volume 191, Number 2, p.329–332, (2016)

Water surface is acidic., Buch, Victoria, Milet Anne, Vacha Robert, Jungwirth Pavel, and J Devlin Paul. , Proc. Natl. Acad. Sci. U. S. A., Volume 104, Number 18, p.7342–7347, (2007)

A way to thioacetate esters compatible with non-oxidative prebiotic conditions, Leqraa, Naoual, Nicolet Yvain, Milet Anne, and Vallee Yannick. , Scientific Reports, Volume 10, p.14488, (2020)

Ynol Ethers from Dichloroenol Ethers: Mechanistic Elucidation Through 35Cl Labeling., Darses, Benjamin, Milet Anne, Philouze Christian, Greene Andrew E., and Poisson Jean-François , Org. Lett., Volume 10, Number 20, p.4445–4447, (2008)

σ-Bond Metathesis Reactions Involving Palladium(II) Hydride and Methyl Complexes: A Theoretical Assessment.}, Milet, Anne, Dedieu Alain, Kapteijn Gerard, and van Koten G , Inorg. Chem., Volume 36, Number 15, p.3223–3231, (1997)