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Crystal structure of 5-chloro-2-(2-fluoro-phen-yl)-3-methyl-sulfinyl-1-benzo-furan.

ABSTRACT: In the title compound, C15H10ClFO2S, the dihedral angle between the mean planes of the benzo-furan ring [r.m.s. deviation = 0.007?(1)?Å] and the 2-fluoro-phenyl ring is 32.53?(5)°. In the crystal, mol-ecules related by inversion are paired into dimers via two different C-H?O hydrogen bonds. Further, Cl?O halogen bonds [3.114?(1)?Å], and F?? [F-to-furan-centroid distance = 3.109?(1)?Å] and S?F [3.1984?(9)?Å] inter-actions link these into a three-dimensional network.

SUBMITTER: Choi HD 

PROVIDER: S-EPMC4571429 | biostudies-literature | 2015 Aug

REPOSITORIES: biostudies-literature

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Crystal structure of 5-chloro-2-(2-fluoro-phen-yl)-3-methyl-sulfinyl-1-benzo-furan.

Choi Hong Dae HD   Lee Uk U  

Acta crystallographica. Section E, Crystallographic communications 20150731 Pt 8

In the title compound, C15H10ClFO2S, the dihedral angle between the mean planes of the benzo-furan ring [r.m.s. deviation = 0.007 (1) Å] and the 2-fluoro-phenyl ring is 32.53 (5)°. In the crystal, mol-ecules related by inversion are paired into dimers via two different C-H⋯O hydrogen bonds. Further, Cl⋯O halogen bonds [3.114 (1) Å], and F⋯π [F-to-furan-centroid distance = 3.109 (1) Å] and S⋯F [3.1984 (9) Å] inter-actions link these into a three-dimensional network. ...[more]

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