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
Zdroj: Journal of Molecular Structure: THEOCHEM. Aug2004, Vol. 682 Issue 1-3, p153-158. 6p.
Databáze: Academic Search Ultimate