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2-[(4-Chlorophenyl)sulfanyl]-2-methoxy-1-phenylethan-1-one: crystal structure and Hirshfeld surface analysis

Authors :
Ignez Caracelli
Julio Zukerman-Schpector
Henrique J. Traesel
Paulo R. Olivato
Mukesh M. Jotani
Edward R. T. Tiekink
Source :
Acta Crystallographica Section E: Crystallographic Communications, Vol 74, Iss 5, Pp 703-708 (2018)
Publication Year :
2018
Publisher :
International Union of Crystallography, 2018.

Abstract

The title compound, C15H13ClO2S, comprises (4-chlorophenyl)sulfanyl, benzaldehyde and methoxy residues linked at a chiral methine-C atom (the crystal is racemic). A twist in the methine-C—C(carbonyl) bond [O—C—C—O torsion angle = 19.3 (7)°] leads to a dihedral angle of 22.2 (5)° between the benzaldehyde and methine+methoxy residues. The chlorobenzene ring is folded to lie over the O atoms, with the dihedral angle between the benzene rings being 42.9 (2)°. In the crystal, the carbonyl-O atom accepts two C—H...O interactions with methyl- and methine-C—H atoms being the donors. The result is an helical supramolecular chain aligned along the c axis; chains pack with no directional interactions between them. An analysis of the Hirshfeld surface points to the important contributions of weak H...H and C...C contacts to the molecular packing.

Details

Language :
English
ISSN :
20569890 and 04879414
Volume :
74
Issue :
5
Database :
Directory of Open Access Journals
Journal :
Acta Crystallographica Section E: Crystallographic Communications
Publication Type :
Academic Journal
Accession number :
edsdoj.100ec04879414f478252f8d88d597a15
Document Type :
article
Full Text :
https://doi.org/10.1107/S2056989018006072