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Multi‐Pathway Consequent Chemoselectivities of...
Journal article

Multi‐Pathway Consequent Chemoselectivities of CpRuCl(PPh3)2/MeI‐Catalysed Norbornadiene Alkyne Cycloadditions

Abstract

Chemoselectivities of five experimentally realised CpRuCl(PPh3 )2 /MeI-catalysed couplings of 7-azabenzo-norbornadienes with selected alkynes were successfully resolved from multiple reaction pathway models. Density functional theory calculations showed the following mechanistic succession to be energetically plausible: (1) CpRuI catalyst activation; (2) formation of crucial metallacyclopentene intermediate; (3) cyclobutene product (P2) …

Authors

Mu W; Fang D; Xia S; Cheng R; Chass GA

Journal

Chemistry - A European Journal, Vol. 22, No. 43, pp. 15396–15403

Publisher

Wiley

Publication Date

October 17, 2016

DOI

10.1002/chem.201603173

ISSN

0947-6539