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Ethyl 4-(4-methoxyphenyl)-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate

Authors :
B. Kalluraya
Jyothi N. Rao
Samuel Robinson Jebas
Hoong-Kun Fun
Source :
Acta Crystallographica Section E, Vol 64, Iss 12, Pp o2448-o2448 (2008)
Publication Year :
2008
Publisher :
International Union of Crystallography, 2008.

Abstract

The asymmetric unit of the title compound, C22H22O4, consists of two independent molecules (A and B) which differ significantly in the orientations of ethyl carboxylate groups. The phenyl ring in molecule B is disordered over two orientations with occupancies of 0.55 (2) and 0.45 (2). The cyclohexenone ring of both molecules adopts an envelope conformation. The dihedral angle between the two aromatic rings is 81.12 (7)° in molecule A and 70.8 (3)° in molecule B [57.5 (4)° in the minor disorder component]. The crystal structure is stabilized by weak intermolecular C—H...O hydrogen bonds and C—H...π interactions.

Subjects

Subjects :
Crystallography
QD901-999

Details

Language :
English
ISSN :
16005368
Volume :
64
Issue :
12
Database :
Directory of Open Access Journals
Journal :
Acta Crystallographica Section E
Publication Type :
Academic Journal
Accession number :
edsdoj.65f9a2b68ab7425aac4ea6b1b4ff4a30
Document Type :
article
Full Text :
https://doi.org/10.1107/S1600536808039093