Joint QTAIM and Hirshfeld study of the σ and π charge distribution and electron delocalization in carbonyl compounds: A comparative study with the resonance model

  1. Mandado, M.
  2. Van Alsenoy, C.
  3. Mosquera, R.A.
Revista:
Journal of Physical Chemistry A

ISSN: 1089-5639

Ano de publicación: 2005

Volume: 109

Número: 38

Páxinas: 8624-8631

Tipo: Artigo

DOI: 10.1021/JP051953S GOOGLE SCHOLAR
Fonte de datos: Scopus