Theoretical chemistry of gold

P Pyykkö - Angewandte Chemie International Edition, 2004 - Wiley Online Library
Theoretical Chemistry of Gold - Pyykkö - 2004 - Angewandte Chemie International Edition - Wiley
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Theoretical studies in palladium and platinum molecular chemistry

A Dedieu - Chemical Reviews, 2000 - ACS Publications
The chemistry of palladium and platinum is one of the most extensive and versatile fields of
chemistry. This results from the fact that these two metals can very easily form adducts with …

Theoretische Chemie des Golds

P Pyykkö - Angewandte Chemie, 2004 - Wiley Online Library
Abstract Die besonderen Eigenschaften des Golds sind entscheidend durch relativistische
Effekte bestimmt. Mittlerweile existiert eine Vielzahl zuverlässiger Rechnungen zu …

Electronic and steric effects on the reductive elimination of diaryl ethers from palladium (II)

G Mann, Q Shelby, AH Roy, JF Hartwig - Organometallics, 2003 - ACS Publications
Arylpalladium aryloxide complexes containing sterically and electronically varied phosphine
ligands were prepared, and the rates for reductive elimination of diaryl ethers from these …

[PDF][PDF] Rhodium (I) complexes of a PBP ambiphilic ligand: evidence for a metal-> borane interaction

S Bontemps, H Gornitzka, G Bouhadir… - Angewandte Chemie …, 2006 - academia.edu
Results The structural parameters for the model complex 4* were determined at different
levels of theory. The BP86 functional led to a significantly better agreement between the …

The chemistry of binuclear palladium (II) and platinum (II) complexes

VK Jain, L Jain - Coordination Chemistry Reviews, 2005 - Elsevier
The chemistry of binuclear palladium (II) and platinum (II) complexes has been reviewed.
This review deals with complexes derived from various classes of ligands and covers …

Modeling the hydrodesulfurization reaction at nickel. Unusual reactivity of dibenzothiophenes relative to thiophene and benzothiophene

DA Vicic, WD Jones - Journal of the American Chemical Society, 1999 - ACS Publications
The nickel hydride dimer [(dippe) NiH] 2 (1) was found to react with a variety of organosulfur
substrates under mild conditions leading to C− S bond insertion adducts. The transition …

[图书][B] Relativistic Theory of Atoms and Molecules III: A Bibliography 1993–1999

P Pyykkö - 2013 - books.google.com
Relativistic effects are of major importance for understanding the properties of heavier atoms
and molecules. Volumes I-III of Relativistic Theory of Atoms and Molecules constitute the …

Theory does not support an osmaoxetane intermediate in the osmium-catalyzed dihydroxylation of olefins

S Dapprich, G Ujaque, F Maseras… - Journal of the …, 1996 - ACS Publications
The osmium-catalyzed asymmetric dihydroxylation of olefins (Scheme 1) is a highly efficient
and experimentally well-studied example of the application of transition metal complexes for …

Structural characterization, solution studies, and DFT calculations on a series of binuclear gold (III) oxo complexes: relationships to biological properties

C Gabbiani, A Casini, L Messori, A Guerri… - Inorganic …, 2008 - ACS Publications
A series of structurally related oxo-bridged binuclear gold (III) compounds,[Au2 (μ-O) 2 (N^
N) 2](PF6) 2, where N^ N is 2, 2′-bipyridine or a substituted 2, 2′-bipyridine, have recently …