NBO analysis of polar and steric effect using the axial-equatorial equilibrium of cyclohexyl acetates as a probe

: Kari Neuvonen, Helmi Neuvonen, Andreas Koch, Erich Kleinpeter

Publisher: Elsevier B.V.

: 2011

: Computational and Theoretical Chemistry

: 1-3

: 964

: 1-3

: 234

: 242

: 9

: 2210-271X

DOI: https://doi.org/10.1016/j.comptc.2010.12.033

: wileyonlinelibrary.com