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Results: 1-8 |
Results: 8

Authors: Pokon, EK Liptak, MD Feldgus, S Shields, GC
Citation: Ek. Pokon et al., Comparison of CBS-QB3, CBS-APNO, and G3 predictions of gas phase deprotonation data, J PHYS CH A, 105(45), 2001, pp. 10483-10487

Authors: Feldgus, S Landis, CR
Citation: S. Feldgus et Cr. Landis, Origin of enantioreversal in the rhodium-catalyzed asymmetric hydrogenation of prochiral enamides and the effect of the alpha-substituent, ORGANOMETAL, 20(11), 2001, pp. 2374-2386

Authors: Feldgus, S Shields, GC
Citation: S. Feldgus et Gc. Shields, An ONIOM study of the Bergman reaction: a computationally efficient and accurate method for modeling the enediyne anticancer antibiotics, CHEM P LETT, 347(4-6), 2001, pp. 505-511

Authors: Landis, CR Feldgus, S
Citation: Cr. Landis et S. Feldgus, A simple model for the origin of enantioselection and the anti "lock-and-key" motif in asymmetric hydrogenation of enamides as catalyzed by chiral diphosphine complexes of Rh(I), ANGEW CHEM, 39(16), 2000, pp. 2863-2866

Authors: Landis, CR Feldgus, S Uddin, J Wozniak, CE Moloy, KG
Citation: Cr. Landis et al., Computational assessment of the effect of sigma-pi bonding synergy and reorganization energies on experimental trends in rhodium-phosphine bond enthalpies, ORGANOMETAL, 19(23), 2000, pp. 4878-4886

Authors: Feldgus, S Landis, CR Glendening, ED Weinhold, F
Citation: S. Feldgus et al., Natural resonance theory. I. General formalism (vol 19, pg 593, 1998), J COMPUT CH, 21(5), 2000, pp. 411-413

Authors: Feldgus, S Landis, CR
Citation: S. Feldgus et Cr. Landis, Large-scale computational modeling of [Rh(DuPHOS)](+)-catalyzed hydrogenation of prochiral enamides: Reaction pathways and the origin of enantioselection, J AM CHEM S, 122(51), 2000, pp. 12714-12727

Authors: Landis, CR Hilfenhaus, P Feldgus, S
Citation: Cr. Landis et al., Structures and reaction pathways in rhodium(I)-catalyzed hydrogenation of enamides: A model DFT study, J AM CHEM S, 121(38), 1999, pp. 8741-8754
Risultati: 1-8 |