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Article Abstract
Herein, we report a UiO-67-type metal-organic framework as an efficient photocatalyst for the selenyltrifluoromethylation of terminal alkynes. The CF• radical species can be effectively stabilized within the confined space of UiO-67-Ru, which contributes to the superior -selectivity and catalytic activity. Furthermore, the -selectivity of the obtained ()-α,β-unsaturated selenotrifluoromethyl compounds is well elucidated by means of density functional theory (DFT) calculations and canonical Monte Carlo (CMC) simulation.
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| http://dx.doi.org/10.1021/acs.orglett.5c01983 | DOI Listing |
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