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Crystal structure of N-(3-benzoyl-4,5,6,7-tetra-hydro-1-benzo-thio-phen-2-yl)benzamide.

ABSTRACT: In the title compound, C22H19NO2S, the cyclo-hexene ring adopts a half-chair conformation. The dihedral angles between the plane of the thio-phene ring and those of its amide- and carbonyl-bonded benzene rings are 7.1?(1) and 59.0?(2)°, respectively. An intra-molecular N-H?O hydrogen bond generates an S(6) ring. In the crystal, very weak aromatic ?-? stacking inter-actions [centroid-centroid separation = 3.9009?(10)?Å] are observed.

SUBMITTER: Kaur M

PROVIDER: S-EPMC4186148 | biostudies-literature | 2014 Sep

REPOSITORIES: biostudies-literature

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Crystal structure of N-(3-benzoyl-4,5,6,7-tetra-hydro-1-benzo-thio-phen-2-yl)benzamide.

Kaur Manpreet M Jasinski Jerry P JP Yathirajan H S HS Yamuna Thammarse S TS Byrappa K K

Acta crystallographica. Section E, Structure reports online 20140801 Pt 9

In the title compound, C22H19NO2S, the cyclo-hexene ring adopts a half-chair conformation. The dihedral angles between the plane of the thio-phene ring and those of its amide- and carbonyl-bonded benzene rings are 7.1 (1) and 59.0 (2)°, respectively. An intra-molecular N-H⋯O hydrogen bond generates an S(6) ring. In the crystal, very weak aromatic π-π stacking inter-actions [centroid-centroid separation = 3.9009 (10) Å] are observed. ...[more]

PMID: 25309274

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