Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-. Understanding anion assistance in C-X bond activation

A. Diefenbach; G.T. de Jong; F.M. Bickelhaupt

doi:10.1021/ct0499478

Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-. Understanding anion assistance in C-X bond activation

A. Diefenbach, G.T. de Jong, F.M. Bickelhaupt

Theoretical Chemistry

Research output: Contribution to Journal › Article › Academic › peer-review

Abstract

To understand the mechanism of anion assistance in palladium-catalyzed H-H, C-H, C-C and C-Cl bond activation, several mechanistic pathways for oxidative addition of Pd and PdCl

Original language	English
Pages (from-to)	286-298
Journal	Journal of Chemical Theory and Computation
Volume	1
Issue number	2
DOIs	https://doi.org/10.1021/ct0499478
Publication status	Published - 2005

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title = "Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-. Understanding anion assistance in C-X bond activation",

abstract = "To understand the mechanism of anion assistance in palladium-catalyzed H-H, C-H, C-C and C-Cl bond activation, several mechanistic pathways for oxidative addition of Pd and PdCl",

author = "A. Diefenbach and {de Jong}, G.T. and F.M. Bickelhaupt",

year = "2005",

doi = "10.1021/ct0499478",

language = "English",

volume = "1",

pages = "286--298",

journal = "Journal of Chemical Theory and Computation",

issn = "1549-9618",

publisher = "American Chemical Society",

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TY - JOUR

T1 - Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-. Understanding anion assistance in C-X bond activation

AU - Diefenbach, A.

AU - de Jong, G.T.

AU - Bickelhaupt, F.M.

PY - 2005

Y1 - 2005

N2 - To understand the mechanism of anion assistance in palladium-catalyzed H-H, C-H, C-C and C-Cl bond activation, several mechanistic pathways for oxidative addition of Pd and PdCl

AB - To understand the mechanism of anion assistance in palladium-catalyzed H-H, C-H, C-C and C-Cl bond activation, several mechanistic pathways for oxidative addition of Pd and PdCl

U2 - 10.1021/ct0499478

DO - 10.1021/ct0499478

M3 - Article

SN - 1549-9618

VL - 1

SP - 286

EP - 298

JO - Journal of Chemical Theory and Computation

JF - Journal of Chemical Theory and Computation

IS - 2

ER -

Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-. Understanding anion assistance in C-X bond activation

Abstract

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