Ontology highlight
ABSTRACT:
SUBMITTER: Choi HD
PROVIDER: S-EPMC2970418 | biostudies-literature | 2009 Sep
REPOSITORIES: biostudies-literature
Acta crystallographica. Section E, Structure reports online 20090919 Pt 10
In the title compound, C(21)H(13)BrO(4)S·C(6)H(6), the O atom and the phenyl group of the phenyl-sulfinyl substituent are located on opposite sides of the mean plane of the 5,6-methyl-enedioxy-benzofuran fragment; the phenyl ring is almost perpendicular to this plane [83.66 (6)°]. The 4-bromo-phenyl ring is rotated slightly out of the 5,6-methyl-enedioxy-benzo-furan plane, making a dihedral angle of 2.9 (1)°. The crystal structure is stabilized by inter-molecular C-H⋯O hydrogen bonds and inter-m ...[more]