Hyperconjugative Effect on the Electronic Wavefunctions of Ethanol

Details Hyperconjugative Effect on the Electronic Wavefunctions of Ethanol Hyperconjugative Effect on the Electronic Wavefunctions of Ethanol

2008-08-29

arxiv.org/abs/0808.4072v1

Physics

Chemical Physics

3 Figures, 1 Scheme. Submitted

Scientific paper

10.1016/j.cplett.2009.02.064

Hyperconjugation is a basic conception of chemistry. Its straightforward effect is exhibited by the spatial delocalization characteristics of the electron density distributions or wavefunctions. Such effects on the electron wavefunctions of the highest-occupied molecular orbitals (HOMO) of two ethanol conformers are demonstrated with electron momentum spectroscopy together with natural bond orbital analyses, exhibiting the distinctly different symmetries of the HOMO wavefunctions in momentum space.

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