The rearrangement pathway in [Cp2Mo2(CO)4(RC≡C-CR2)]+ cations : an extended Hückel molecular orbital and Bürgi-Dunitz trajectory study: Theoretical and computational organometallic chemistry

Bibliographische Detailangaben

Veröffentlicht in:	Journal of organometallic chemistry 1994, Vol.478 (1-2), p.189-196
Hauptverfasser:	GIRARD, L, LOCK, P. E, EL AMOURI, H, MCGLINCHEY, M. J
Format:	Artikel
Sprache:	eng
Schlagworte:	Atomic and molecular physics Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) Electronic structure of atoms, molecules and their ions: theory Exact sciences and technology Physics Semi-empirical and empirical calculations (differential overlap, hückel, ppp methods, etc.) Statistical model calculations (including Thomas-Fermi and Thomas-Fermi-Dirac models)
Online-Zugang:	Volltext
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