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How Solvation Influences the S<sub>N</sub>2 versus E2 Competition

Thomas Hansen, Jasper C. Roozee, F. Matthias Bickelhaupt, Trevor A. Hamlin

2021The Journal of Organic Chemistry48 citationsDOIOpen Access PDF

Abstract

2 pathway becomes viable.

Topics & Concepts

SolvationChemistrySN2 reactionImplicit solvationLewis acids and basesDensity functional theoryComputational chemistryNucleophileBase (topology)DichloromethaneChemical physicsSolventStereochemistryOrganic chemistryCatalysisMathematical analysisMathematicsAdvanced Chemical Physics StudiesChemical Reaction MechanismsIonic liquids properties and applications
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