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A Theoretical Study of the Relationship between Secondary .alpha.-Deuterium Kinetic Isotope Effects and the Structure of SN2 Transition States

โœ Scribed by Poirier, Raymond A.; Wang, Youliang; Westaway, Kenneth C.


Book ID
127023324
Publisher
American Chemical Society
Year
1994
Tongue
English
Weight
886 KB
Volume
116
Category
Article
ISSN
0002-7863

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The quazitative HOMO-LVMO orbital interaction interpretation of the aZpha effect is found to be invaZid for anionic nucleophiles. In any event, gas phase SN2 reactions of HOO-and FO'O-show no evidence of the effect. The role of a hydroxylic solvent requires greater consideration as the source of pos