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5-Iodo-2-phenyl-3-phenyl-sulfinyl-1-benzofuran.

ABSTRACT: In the title compound, C(20)H(13)IO(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 [83.84?(5)°]. The phenyl ring in the 2-position is rotated out of the benzofuran plane, making a dihedral angle of 40.47?(5)°. The crystal structure is stabilized by non-classical inter-molecular C-H?O inter-actions, and by an I?O halogen bond of 3.124?(1)?Å [C-I?O = 165.84?(5)°].

SUBMITTER: Choi HD

PROVIDER: S-EPMC2977478 | biostudies-literature | 2009 Jul

REPOSITORIES: biostudies-literature

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5-Iodo-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 20090711 Pt 8

In the title compound, C(20)H(13)IO(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 [83.84 (5)°]. The phenyl ring in the 2-position is rotated out of the benzofuran plane, making a dihedral angle of 40.47 (5)°. The crystal structure is stabilized by non-classical inter-molecular C-H⋯O inter-actions, and by an I⋯O halogen bond of 3.124 (1) Å [C-I⋯O = 165.84 ...[more]

PMID: 21583512

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