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- W4210898174 abstract "Comprehensive Summary The carbonyl–olefin ring‐closing metathesis reactions have become a powerful tool for carbon‐carbon bond formation. In this work, the halogen bond catalysis and classical Lewis acid catalysis on the carbonyl–olefin ring‐closing metathesis reaction were investigated by density function theory. For both the halogen bond catalysis and classical Lewis acid catalysis, the carbonyl–olefin ring‐closing metathesis reaction occurs by [2 + 2]‐cycloaddition process and [2 + 2]‐cycloreversion process, the reaction energy barriers are low, therefore, it can be performed easily at room temperature. The essential difference of the two kinds of catalysts is that the catalytic mechanism of halogen bond catalysis is mainly contribution of electrostatic interaction, while that of classical Lewis acid catalysis is mainly catalyzed by orbital interaction. The halogen bond donor catalysts (ICl 3 , IF 3 ) are expected to be efficient catalysts for the reaction and further promote the chemical synthesis of carbonyl–olefin ring‐closing metathesis reaction." @default.
- W4210898174 created "2022-02-09" @default.
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- W4210898174 date "2022-02-28" @default.
- W4210898174 modified "2023-09-23" @default.
- W4210898174 title "Halogen Bond Catalysis on Carbonyl–Olefin <scp>Ring‐Closing</scp> Metathesis Reaction: Comparison with Lewis Acid Catalysis" @default.
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- W4210898174 doi "https://doi.org/10.1002/cjoc.202100891" @default.
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