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- W2010363089 abstract "A series of nucleophilic substitution reactions involving simple species (chloride, phosphide, methoxide, hydroxide, and amide) as nucleophile and leaving group in methylsulfenyl derivatives were examined at B3LYP/aug-cc-pVDZ. The reactions involving hydroxide and amide correspond to deprotonation and not substitution. The substitution reactions follow an addition-elimination pathway, possessing a triple-well potential energy surface. The intermediate along this pathway is of trigonal bipyramid geometry with the nucleophile and leaving group occupying apical positions." @default.
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- W2010363089 title "Theoretical Study of Nucleophilic Substitution at Two-Coordinate Sulfur" @default.
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- W2010363089 doi "https://doi.org/10.1021/jo001463q" @default.
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