Mechanism and Transition-State Structures for Nickel-Catalyzed Reductive Alkyne−Aldehyde Coupling Reactions
The mechanism of nickel-catalyzed reductive alkyne−aldehyde coupling reactions has been investigated using density functional theory. The preferred mechanism involves oxidative cyclization to form the nickeladihydrofuran intermediate followed by transmetalation and reductive elimination. The rate- a...
Main Authors: | McCarren, Patrick R. (Author), Liu, Peng (Author), Cheong, Paul Ha-Yeon (Author), Jamison, Timothy F. (Contributor), Houk, K. N. (Author) |
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Other Authors: | Massachusetts Institute of Technology. Department of Chemistry (Contributor) |
Format: | Article |
Language: | English |
Published: |
American Chemical Society (ACS),
2013-11-13T15:09:02Z.
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Subjects: | |
Online Access: | Get fulltext |
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