Application of conformational analysis techniques to the prediction of heats of formation and gas‐phase thermodynamic functions
- 1 September 1973
- journal article
- Published by Wiley in AIChE Journal
- Vol. 19 (5), 1016-1024
- https://doi.org/10.1002/aic.690190519
Abstract
No abstract availableKeywords
This publication has 20 references indexed in Scilit:
- Consistent Force Field Calculations. II. Crystal Structures, Sublimation Energies, Molecular and Lattice Vibrations, Molecular Conformations, and Enthalpies of AlkanesThe Journal of Chemical Physics, 1970
- Heats of combustion and strain energies of bicyclo[n.m.O]alkanesJournal of the American Chemical Society, 1970
- Conformational analysis. LX. Improved calculations of the structures and energies of hydrocarbons by the Westheimer methodJournal of the American Chemical Society, 1968
- Conformational analysis. LVII. The calculation of the conformational structures of hydrocarbons by the Westheimer-Hendrickson-Wiberg methodJournal of the American Chemical Society, 1967
- Conformational Analysis of Macromolecules. II. The Rotational Isomeric States of the Normal HydrocarbonsThe Journal of Chemical Physics, 1966
- A Scheme for Strain Energy Minimization. Application to the Cycloalkanes1Journal of the American Chemical Society, 1965
- A valence force field for saturated hydrocarbonsSpectrochimica Acta, 1965
- Molecular Geometry. II. Methyl-cyclohexanes and CycloheptanesJournal of the American Chemical Society, 1962
- Molecular Geometry. I. Machine Computation of the Common RingsJournal of the American Chemical Society, 1961
- The Thermodynamics and Molecular Structure of Cyclopentane1Journal of the American Chemical Society, 1947