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- Title
Prediction of the vaporization enthalpy based on modified Randič indices. I. Monohydric alcohols.
- Authors
Krasnykh, E. L.
- Abstract
The vaporization enthalpy of monohydric alcohols with different structures under normal conditions is calculated using a modified Randič method with an error comparable to the experimental one. The energy of hydrogen bonds in alcohols is determined and shown to be constant and independent on the alcohol structure.
- Subjects
ENTHALPY; ALCOHOLS (Chemical class); HYDROGEN bonding; SPECIFIC heat; EQUATIONS
- Publication
Journal of Structural Chemistry, 2009, Vol 50, Issue 3, p556
- ISSN
0022-4766
- Publication type
Article
- DOI
10.1007/s10947-009-0084-1