A Density Functional Theory Investigation of the Cobalt-Mediated eta super(5)-Pentadienyl/Alkyne [5+2] Cycloaddition Reaction: Mechanistic Insight and Substituent Effects

Alkyl-substituted eta super(5)-pentadienyl half-sandwich complexes of cobalt have been reported to undergo [5+2] cycloaddition reactions with alkynes to provide eta super(2), eta super(3)-cycloheptadienyl complexes under kinetic control. DFT studies have been used to elucidate the mechanism of the c...

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Veröffentlicht in:	Chemistry : a European journal 2012-08, Vol.18 (32), p.9894-9900
Hauptverfasser:	Ylijoki, Kai EO, Budzelaar, Peter HM, Stryker, Jeffrey M
Format:	Artikel
Sprache:	eng
Schlagworte:	Alkynes Bonding Cobalt Constraining Cycloaddition Isomerization Olefins Reaction kinetics
Online-Zugang:	Volltext
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