{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["66(Pt 2)"],"submitter":["Choi HD"],"pubmed_abstract":["In the title compound, C(16)H(12)BrFO(2)S, the 4-fluoro-phenyl ring is rotated out of the benzofuran plane, as indicated by the dihedral angle of 5.94 (5)°. The crystal structure exhibits aromatic π-π inter-actions between the benzene ring and the 4-fluoro-phenyl ring of an adjacent mol-ecule [centroid-centroid distance = 3.632 (2) Å], and a Br⋯O halogen bond with a Br⋯O distance of 3.101 (1) Å."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o323"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC2979841"],"repository":["biostudies-literature"],"pubmed_title":["5-Bromo-3-ethyl-sulfinyl-2-(4-fluoro-phenyl)-1-benzofuran."],"pmcid":["PMC2979841"],"pubmed_authors":["Son BW","Choi HD","Seo PJ","Lee U"],"additional_accession":[]},"is_claimable":false,"name":"5-Bromo-3-ethyl-sulfinyl-2-(4-fluoro-phenyl)-1-benzofuran.","description":"In the title compound, C(16)H(12)BrFO(2)S, the 4-fluoro-phenyl ring is rotated out of the benzofuran plane, as indicated by the dihedral angle of 5.94 (5)°. The crystal structure exhibits aromatic π-π inter-actions between the benzene ring and the 4-fluoro-phenyl ring of an adjacent mol-ecule [centroid-centroid distance = 3.632 (2) Å], and a Br⋯O halogen bond with a Br⋯O distance of 3.101 (1) Å.","dates":{"release":"2010-01-01T00:00:00Z","publication":"2010 Jan","modification":"2025-04-26T21:40:59.354Z","creation":"2019-03-27T00:00:56Z"},"accession":"S-EPMC2979841","cross_references":{"pubmed":["21579753"],"doi":["10.1107/S1600536810000590"]}}