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5-Chloro-7-methyl-2-phenyl-3-phenyl-sulfinyl-1-benzofuran.

ABSTRACT: In the title compound, C(21)H(15)ClO(2)S, the O atom and the phenyl group of the phenyl-sulfinyl substituent lie on opposite sides of the plane of the benzofuran fragment; the phenyl ring is almost perpendicular to this plane [82.24?(7)°]. The phenyl ring in the 2-position is rotated out of the benzofuran plane, making a dihedral angle of 11.50?(9)°. The crystal structure is stabilized by inter-molecular C-H?O and C-H?Cl inter-actions. In addition, the stacked mol-ecules exhibit an inter-molecular S?O inter-action [3.327?(2)?Å] involving the sulfinyl groups.

SUBMITTER: Choi HD

PROVIDER: S-EPMC2977311 | biostudies-other | 2009

REPOSITORIES: biostudies-other

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5-Chloro-7-methyl-2-phenyl-3-phenyl-sulfinyl-1-benzofuran.

Choi Hong Dae HD Seo Pil Ja PJ Son Byeng Wha BW Lee Uk U

Acta crystallographica. Section E, Structure reports online 20090704 Pt 8

In the title compound, C(21)H(15)ClO(2)S, the O atom and the phenyl group of the phenyl-sulfinyl substituent lie on opposite sides of the plane of the benzofuran fragment; the phenyl ring is almost perpendicular to this plane [82.24 (7)°]. The phenyl ring in the 2-position is rotated out of the benzofuran plane, making a dihedral angle of 11.50 (9)°. The crystal structure is stabilized by inter-molecular C-H⋯O and C-H⋯Cl inter-actions. In addition, the stacked mol-ecules exhibit an inter-molecul ...[more]

PMID: 21583477

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