Croatica Chemica Acta, Vol. 62 No. 4, 1989.
Izlaganje sa skupa
Photoelectron Spectra, MNDO Calculations and Electronic Structure of Some Saturated Steroids
Lj. Paša Tolić
; The Ruđer Bošković Institute, University of Zagreb, YU-41001, Zagreb Yugoslavia
B. Kovač
; The Ruđer Bošković Institute, University of Zagreb, YU-41001, Zagreb Yugoslavia
L. Klasinc
; The Ruđer Bošković Institute, University of Zagreb, YU-41001, Zagreb Yugoslavia
J. V. Knop
; Rechenzentrum der Universitet Dusseldorf, Dusseldorf, FR Germany
C. Kubli-Garfias
; Unidad de Investigacion Biomedica del CMN, IMSS, Mexico City, Mexico
S. P. McGlynn
; Department of Chemistry, Louisiana State University, Baton Rouge, La. 7080
Sažetak
Photoelectron (PE) spectra in conection with semiempirical MNDO SCF MO calculations (assuming validity of Koopmans'theorem) and empirical arguments (i. e. composite molecule method) are used to derive (valence) electron structure of 5a-androstane (1), 5a-androstan-3-one (2), 5a-androstan-11-one (3), 5aandrostan- 17-one (4), 5a-androstane-3,17-dione (5) and 5a-androstane-3,11,17-trione (6).
Ključne riječi
Hrčak ID:
175839
URI
Datum izdavanja:
25.2.1990.
Posjeta: 737 *