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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


Puni tekst: engleski pdf 5.122 Kb

str. 813-823

preuzimanja: 155

citiraj


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

https://hrcak.srce.hr/175839

Datum izdavanja:

25.2.1990.

Posjeta: 433 *