On simple, accurate calculations of atomic charges, bond properties and molecular energies. IV. Butane gauche interactions and vibrational energies of alkylcyclohexanes and related polycyclic hydrocarbons
Autor: | Fliszár, S.1 fliszars@chimie.umontreal.ca, Vauthier, E.C.2, Chrétien, S.3 |
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Zdroj: | Journal of Molecular Structure: THEOCHEM. Aug2004, Vol. 682 Issue 1-3, p153-158. 6p. |
Databáze: | Academic Search Ultimate |
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