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- W2319135596 abstract "Through-bond (TB) and through-space (TS) substituent effects in substituted alkyl, alkenyl, and alkynyl arenes are quantified separately using molecular electrostatic potential (MESP) topographical analysis. The deepest MESP point over the aromatic ring (Vmin) is considered as a probe for monitoring these effects for a variety of substituents. In the case of substituted alkyl chains, the TS effect (79.6%) clearly dominates the TB effect, whereas in the unsaturated analogues the TB effect (∼55%) overrides the TS effect." @default.
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- W2319135596 date "2010-11-02" @default.
- W2319135596 modified "2023-10-02" @default.
- W2319135596 title "Appraisal of Through-Bond and Through-Space Substituent Effects via Molecular Electrostatic Potential Topography" @default.
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- W2319135596 doi "https://doi.org/10.1021/jp107689z" @default.
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