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3-(4-Bromo-phenyl-sulfin-yl)-5-chloro-2-methyl-1-benzofuran.

ABSTRACT: In the title compound, C(15)H(10)BrClO(2)S, the 4-bromo-phenyl ring makes a dihedral angle of 86.85 (6)° with the mean plane [mean deviation = 0.009 (2) Å] of the benzofuran fragment. In the crystal, mol-ecules are linked by slipped π-π inter-actions between the benzene and the furan rings of adjacent mol-ecules [centroid-centroid distance = 3.884 (2), inter-planar distance = 3.369 (2) and slippage = 1.945 (2) Å], and between the 4-bromo-phenyl rings of adjacent mol-ecules [centroid-centroid distance = 3.882 (2), inter-planar distance = 3.552 (2) and slippage = 1.566 (2) Å]. A Br⋯Br [3.6446 (4) Å] halogen inter-action is also observed.

SUBMITTER: Choi HD

PROVIDER: S-EPMC3393896 | biostudies-literature | 2012 Jul

REPOSITORIES: biostudies-literature

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3-(4-Bromo-phenyl-sulfin-yl)-5-chloro-2-methyl-1-benzofuran.

Choi Hong Dae HD Seo Pil Ja PJ Lee Uk U

Acta crystallographica. Section E, Structure reports online 20120613 Pt 7

In the title compound, C(15)H(10)BrClO(2)S, the 4-bromo-phenyl ring makes a dihedral angle of 86.85 (6)° with the mean plane [mean deviation = 0.009 (2) Å] of the benzofuran fragment. In the crystal, mol-ecules are linked by slipped π-π inter-actions between the benzene and the furan rings of adjacent mol-ecules [centroid-centroid distance = 3.884 (2), inter-planar distance = 3.369 (2) and slippage = 1.945 (2) Å], and between the 4-bromo-phenyl rings of adjacent mol-ecules [centroid-centroid dis ...[more]

PMID: 22798761

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5-Bromo-3-(4-chloro-phenyl-sulfin-yl)-2-methyl-1-benzofuran.

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