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5-Bromo-2-(4-fluoro-phen-yl)-7-methyl-3-phenyl-sulfinyl-1-benzo-furan.

ABSTRACT: In the title compound, C21H14BrFO2S, the dihedral angles between the mean plane [r.m.s. deviation = 0.005?(1)?Å] of the benzo-furan ring system and the pendant 4-fluoro-phenyl and phenyl rings are 1.50?(8) and 81.47?(6)°, respectively. In the crystal, mol-ecules are linked by weak C-H?O hydrogen bonds into supra-molecular chains running along the a-axis direction. A short S?O contact [2.9623?(13)?Å] involving the sulfinyl groups is observed between inversion-related chains.

SUBMITTER: Choi HD

PROVIDER: S-EPMC3770401 | biostudies-literature | 2013

REPOSITORIES: biostudies-literature

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5-Bromo-2-(4-fluoro-phen-yl)-7-methyl-3-phenyl-sulfinyl-1-benzo-furan.

Choi Hong Dae HD Seo Pil Ja PJ Lee Uk U

Acta crystallographica. Section E, Structure reports online 20130622 Pt 7

In the title compound, C21H14BrFO2S, the dihedral angles between the mean plane [r.m.s. deviation = 0.005 (1) Å] of the benzo-furan ring system and the pendant 4-fluoro-phenyl and phenyl rings are 1.50 (8) and 81.47 (6)°, respectively. In the crystal, mol-ecules are linked by weak C-H⋯O hydrogen bonds into supra-molecular chains running along the a-axis direction. A short S⋯O contact [2.9623 (13) Å] involving the sulfinyl groups is observed between inversion-related chains. ...[more]

PMID: 24046686

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