Direct ab initio molecular dynamics study on a microsolvated SN2 reaction of OH−(H2O) with CH3Cl
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.2229208
Reference40 articles.
1. Gas phase nucleophilic substitution
2. Deuterium Kinetic Isotope Effects in Gas-Phase SN2 and E2 Reactions: Comparison of Experiment and Theory
3. Rate Constants as a Function of Temperature and Kinetic Energy for the Reactions of Cl- with C2H5Br and n-C3H7Br
4. Secondary Kinetic Isotope Effect in Nucleophilic Substitution: A Quantum-Mechanical Approach
5. The α-Effect in Gas-Phase SN2 Reactions Revisited
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