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Prediction of rate constants ofSN2 reactions by the multicomponent QSPR method

โœ Scribed by Kravtsov, A. A.; Karpov, P. V.; Baskin, I. I.; Palyulin, V. A.; Zefirov, N. S.


Book ID
110160364
Publisher
Springer
Year
2011
Tongue
English
Weight
160 KB
Volume
440
Category
Article
ISSN
0012-5008

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Prediction of rate constants for combust
โœ P. R. Westmoreland; J. B. Howard; J. P. Longwell; A. M. Dean ๐Ÿ“‚ Article ๐Ÿ“… 1986 ๐Ÿ› American Institute of Chemical Engineers ๐ŸŒ English โš– 725 KB

Bimolecular QRRK (Quantum Rice-Ramsperger-Kassel) analysis is a simple method for calculating rate constants of addition and recombination reactions, based on unimolecular quantum-RRK theory. Input parameters are readily derived, and rate constants and reaction branching can be predicted with remark