STRUCTURE OF ZINC TETRAPHENYLPORPHYRIN DIMETHYL FORMAMIDE METHYLENE-CHLORIDE

Citation
Pa. Droege et al., STRUCTURE OF ZINC TETRAPHENYLPORPHYRIN DIMETHYL FORMAMIDE METHYLENE-CHLORIDE, Journal of chemical crystallography, 24(2), 1994, pp. 111-116
Citations number
18
Categorie Soggetti
Crystallography,Spectroscopy
ISSN journal
10741542
Volume
24
Issue
2
Year of publication
1994
Pages
111 - 116
Database
ISI
SICI code
1074-1542(1994)24:2<111:SOZTDF>2.0.ZU;2-A
Abstract
C48H37N5ZnOCl2, M(r) = 836.13, triclinic, P1BAR, a = 11.2231(15), b = 12.5155(18), c = 14.6013(19)angstrom, alpha, = 99.001(7), beta = 94.60 0(8), gamma = 103.221(7)degrees, V = 1957.6(5) angstrom3, Z = 2, D(x) = 1.419 gcm-3, MoKalpha (lambda = 0.7107 angstrom), mu(calc) = 13.4 cm -1, F(000) = 1670, T = 173 +/- 1K, final discrepancy factor 2.8 % for 5274 unique reflections above 2.5 sigma(I) in the range 3 < 2theta < 4 8-degrees. The metal is coordinated to the four nitrogen atoms of the porphyrin ring and the oxygen of the dimethyl formamide moiety. The ge ometry of this porphyrin is nonplanar with respect to the overall stru cture, although the pyrrole rings are nearly coplanar with the zinc me tal pulled out of the plane in the familiar domed-shaped geometry.