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- W1980929358 abstract "Abstract We present evidence that the privileged use of the 3,5‐bis(trifluoromethyl)phenyl group in thiourea organocatalysis is due to the involvement of the ortho ‐CH bond in the binding event with Lewis‐basic sites. We utilized a combination of low‐temperature IR spectroscopy, 2D NMR spectroscopy, nano‐MS (ESI) investigations, as well as density functional theory computations [M06/6‐31+G( d , p ), including solvent corrections as well as natural bond orbital and atoms‐in‐molecules analyses] to support our conclusions that bear implications for catalyst design." @default.
- W1980929358 created "2016-06-24" @default.
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- W1980929358 date "2012-09-11" @default.
- W1980929358 modified "2023-10-17" @default.
- W1980929358 title "Hydrogen-Bonding Thiourea Organocatalysts: The Privileged 3,5-Bis(trifluoromethyl)phenyl Group" @default.
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- W1980929358 doi "https://doi.org/10.1002/ejoc.201200739" @default.
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