Acylation Reactions of Dibenzo‐7‐phosphanorbornadiene: DFT Mechanistic Insights
Abstract Extensive DFT calculations provide deep mechanistic insights into the acylation reactions of tert‐butyl dibenzo‐7‐phosphanobornadiene with PhCOX (X=Cl, Br, I, OTf) in CH2Cl2 solution. Such reactions are initialized by the nucleophilic P⋅⋅⋅C attack to the carbonyl group to form the acylphosp...
Main Authors: | Dr. Zheng‐Wang Qu, Dr. Hui Zhu, Prof. Stefan Grimme |
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Format: | Article |
Language: | English |
Published: |
Wiley-VCH
2019-06-01
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Series: | ChemistryOpen |
Subjects: | |
Online Access: | https://doi.org/10.1002/open.201900176 |
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