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A theoretical study of the basicity of methylamines in the gaseous phase

✍ Scribed by V. V. Zverev; L. V. Ermolaev; Yu. P. Kitaev


Book ID
112488375
Publisher
Springer
Year
1977
Tongue
English
Weight
341 KB
Volume
26
Category
Article
ISSN
1573-9171

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Calculation of the relative basicities o
✍ J.L. Pascual-Ahuir; J. Andres; E. Silla πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 306 KB

The relative basicities in solution ofthe methylamines have been calculated using the model of Miertus, Scrocco and Tomasi to describe the solvent effect. The surface of the cavity is defined with the GEPOL method. The ab initio calculations have been performed using a 4-31G basis set. The relative