Article ID Journal Published Year Pages File Type
5382921 Chemical Physics Letters 2012 6 Pages PDF
Abstract
► The solvatochromic reversal can be predicted by the relative electrophilic Fukui functions of the dye structural moieties. ► As polarity increases, there is an inversion of the relative Fukui functions of the two moieties. ► The electrophilicity index ω may be used to distinguish the solvatochromic behavior of a phenolate betaine dye. ► Linear plots of ω against the dye solvation energy have slope values that increase in the order negative
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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