Theoretical Mechanistic Studies of Rh‐Catalyzed C(sp 3 )—H Amination: A Comparison with Co Analogue and Metal Effects
Abstract
Summary of main observation and conclusion The mechanism of Rh‐catalyzed C(sp 3 )—H amination has been computationally investigated. The reaction mechanism mainly involves sequential C(sp 3 )—H activation, decarboxylation, nitrene migration insertion, and protonation steps. Competitive concerted metalation deprotonation (CMD) and external base assisted deprotonation (EBAD) pathways are found for the involved C(sp 3 )—H activation in both Rh and...
Paper Details
Title
Theoretical Mechanistic Studies of Rh‐Catalyzed C(sp 3 )—H Amination: A Comparison with Co Analogue and Metal Effects
Published Date
Sep 7, 2020
Journal
Volume
38
Issue
12
Pages
1526 - 1532
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