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A theoretical study of solvation energies of FCH2COO−, FCH2COOH, and F2CHCOO−

✍ Scribed by Duli C. Jain; Denyse De Gale; Anne-Marie Sapse

Publisher
John Wiley and Sons
Year
1989
Tongue
English
Weight
390 KB
Volume
10
Category
Article
ISSN
0192-8651

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✦ Synopsis

A continuum and a discrete-continuum models are used to determine the solvation energies of FCH,COO-, FCH,COOH, and FZCHCOO-. For the anions, the continuum model provides results closer to the experiment, while for the acid, the addition of one water molecule improves the continuum-only energy.

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