Experimental and theoretical studies on the oxidative addition of palladium(0) to β-chlorovinamidinium salts

被引:8
作者
Davies, IW
Wu, J
Marcoux, JF
Taylor, M
Hughes, D
Reider, PJ
Deeth, RJ
机构
[1] Merck & Co Inc, Dept Proc Res, Rahway, NJ 07065 USA
[2] Univ Warwick, Inorgan Computat Chem Grp, Coventry CV4 7AL, W Midlands, England
关键词
D O I
10.1016/S0040-4020(01)00350-7
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
Boronic acids, esters and borinic anhydrides are partners in Suzuki-Miyaura cross-coupling reactions with a variety of beta -chlorovinamidinium salts to give the desired beta -arylvinamidinium salts in up to 88% yield. Reduction is a competing reaction pathway. DFT calculations on the intermediate palladium complex reveal that the Pd-C interaction is predominantly of a-symmetry and the metal based LUMO is mainly d(z2) in character. (C) 2001 Elsevier Science Ltd. All rights reserved.
引用
收藏
页码:5061 / 5066
页数:6
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