The effect of microsolvation on E2 and SN2 reactions: Theoretical study of the model system F- + C2H 5F + nHF

Chemistry - A European Journal

Volumn 2, Issue 2, 1996, Pages 196-207

  Bickelhaupt, F Matthias ^a   Baerends, Evert Jan ^a   Nibbering, Nico M M ^b  

^a VU UNIVERSITY AMSTERDAM   (Netherlands)

^b UNIVERSITY OF AMSTERDAM   (Netherlands)

Author keywords

Eliminations; Orbital interactions; Solvent effects; Substitutions; Theoretical chemistry

Indexed keywords

DENSITY-FUNCTIONAL METHODS; ELIMINATIONS; MODEL REACTION SYSTEM; ORBITAL INTERACTION; SOLVENT EFFECTS; SOLVENT MOLECULES; THEORETICAL CHEMISTRY; THEORETICAL STUDY;

ACTIVATION ENERGY; SOLVENTS; SUBSTITUTION REACTIONS;

SOLVATION;

EID: 0000510656     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.19960020212     Document Type: Article

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