Prediction of Vapor Pressures from Self-Solvation Free Energies Calculated by the SM5 Series of Universal Solvation Models
Winget, P.; Hawkins, G. D.; Cramer, C. J.; Truhlar, D. G.
J. Phys. Chem. B 2000, 104, 4726.
The SM5.4, SM5.2R, and SM5.0 solvation models are applied to calculate the vapor pressure of 156 molecules. This provides a test of the solvation models, but--even more so--it provides a useful scheme for estimating the vapor pressure at 298 K of any organic molecule for which a few standard descriptors are known or can be estimated.
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