<HashMap><database>biostudies-literature</database><scores/><additional><omics_type>Unknown</omics_type><volume>68(Pt 5)</volume><submitter>Choi HD</submitter><pubmed_abstract>In the title compound, C(16)H(13)BrO(2)S, the 4-methyl-phenyl ring makes a dihedral angle of 87.83 (6)° with the mean plane [mean deviation = 0.007 (1) Å] of the benzofuran fragment. In the crystal, mol-ecules are linked by weak C-H⋯O hydrogen bonds and Br⋯O contacts [3.099 (2) Å]. The crystal structure also exhibits π-π inter-actions between the furan and benzene rings of neighbouring mol-ecules [centroid-centroid distance = 3.637 (2) Å, inter-planar distance = 3.317 (2) Å and slippage = 1.492 (2) Å].</pubmed_abstract><journal>Acta crystallographica. Section E, Structure reports online</journal><pagination>o1298</pagination><full_dataset_link>https://www.ebi.ac.uk/biostudies/studies/S-EPMC3344444</full_dataset_link><repository>biostudies-literature</repository><pubmed_title>5-Bromo-2-methyl-3-(4-methyl-phenyl-sulfin-yl)-1-benzofuran.</pubmed_title><pmcid>PMC3344444</pmcid><pubmed_authors>Choi HD</pubmed_authors><pubmed_authors>Seo PJ</pubmed_authors><pubmed_authors>Lee U</pubmed_authors></additional><is_claimable>false</is_claimable><name>5-Bromo-2-methyl-3-(4-methyl-phenyl-sulfin-yl)-1-benzofuran.</name><description>In the title compound, C(16)H(13)BrO(2)S, the 4-methyl-phenyl ring makes a dihedral angle of 87.83 (6)° with the mean plane [mean deviation = 0.007 (1) Å] of the benzofuran fragment. In the crystal, mol-ecules are linked by weak C-H⋯O hydrogen bonds and Br⋯O contacts [3.099 (2) Å]. The crystal structure also exhibits π-π inter-actions between the furan and benzene rings of neighbouring mol-ecules [centroid-centroid distance = 3.637 (2) Å, inter-planar distance = 3.317 (2) Å and slippage = 1.492 (2) Å].</description><dates><release>2012-01-01T00:00:00Z</release><publication>2012 May</publication><modification>2025-04-04T14:12:38.226Z</modification><creation>2019-03-27T00:53:05Z</creation></dates><accession>S-EPMC3344444</accession><cross_references><pubmed>22590206</pubmed><doi>10.1107/S160053681201389X</doi></cross_references></HashMap>