Publikationen in Zusammenarbeit mit Forschern von University of Strasbourg (10)

2017

  1. Heteroleptic, two-coordinate [M(NHC){N(SiMe3)2}] (M = Co, Fe) complexes: Synthesis, reactivity and magnetism rationalized by an unexpected metal oxidation state

    Dalton Transactions, Vol. 46, Núm. 4, pp. 1163-1171

2015

  1. Discovery of the K4 Structure Formed by a Triangular π Radical Anion

    Journal of the American Chemical Society, Vol. 137, Núm. 24, pp. 7612-7615

  2. Unprecedented directed lateral lithiations of tertiary carbons on NHC platforms

    Chemical Communications, Vol. 51, Núm. 15, pp. 3049-3052

2006

  1. Nucleophilic attack on phosphate diesters: A density functional study of in-line reactivity in dianionic, monoanionic, and neutral systems

    Journal of Physical Chemistry B, Vol. 110, Núm. 23, pp. 11525-11539

  2. On the affinity regulation of the metal-ion-dependent adhesion sites in integrins

    Journal of the American Chemical Society, Vol. 128, Núm. 11, pp. 3554-3563

2003

  1. Alkaline hydrolysis of amide bonds: Effect of bond twist and nitrogen pyramidalization

    Journal of Physical Chemistry A, Vol. 107, Núm. 13, pp. 2304-2315

2002

  1. Theoretical evaluation of pKa in phosphoranes: Implications for phosphate ester hydrolysis

    Journal of the American Chemical Society, Vol. 124, Núm. 18, pp. 5010-5018

2001

  1. Solvent effects on the reaction coordinate of the hydrolysis of phosphates and sulfates: Application of hammond and anti-hammond postulates to understand hydrolysis in solution

    Journal of the American Chemical Society, Vol. 123, Núm. 47, pp. 11755-11763

  2. Synthesis of a novel diarylphosphinic acid: A distorted ground state mimic and transition state analogue for amide hydrolysis

    Tetrahedron, Vol. 57, Núm. 52, pp. 10299-10307

1999

  1. Mechanism of alkaline hydrolysis of cyclic and acyclic sulfates: An ab initio study with solvation correction

    Journal of the American Chemical Society, Vol. 121, Núm. 23, pp. 5548-5558