A Mechanistic Study of Direct Activation of Allylic Alcohols in Palladium Catalyzed Amination Reactions

We here report a computational approach on the mechanism of allylicamination reactions using allyl-alcohols and amines as the substrates and phosphoramidite palladium catalyst 1a, which operates in the presence of catalytic amount of 1,3-diethylurea as a co-catalyst. DFT calculations showed a coope...

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Bibliographic Details
Main Authors: Yasemin Gumrukcu, Bas de Bruin, Joost N. H. Reek
Format: Article
Language:English
Published: MDPI AG 2015-03-01
Series:Catalysts
Subjects:
Online Access:http://www.mdpi.com/2073-4344/5/1/349