{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["66(Pt 5)"],"submitter":["Dutkiewicz G"],"pubmed_abstract":["The title compound, C(15)H(10)BrFO, is isostructural with (2E)-1-(4-chloro-phen-yl)-3-(4-fluoro-phen-yl)prop-2-en-1-one [Qiu et al. (2006 ▶). Acta Cryst. E62, o3525-o3526], but the structures of other dihalogen analogues, without fluorine, are different, although they are also isostructural within the series. The mol-ecule is approximately flat, the dihedral angle between the ring planes being 8.49 (13)°. In the crystal structure, inter-molecular C-H⋯O, C-H⋯F and C-H⋯Br hydrogen bonds link mol-ecules into V-shaped ribbons running parallel to [101] and stacked with an inter-planar distance of approximately 3.53 Å (centroid-vcentroid distance = 3.857 Å).."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1243-4"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC2979273"],"repository":["biostudies-literature"],"pubmed_title":["(2E)-1-(4-Bromo-phen-yl)-3-(4-fluoro-phen-yl)prop-2-en-1-one."],"pmcid":["PMC2979273"],"pubmed_authors":["Veena K","Yathirajan HS","Kubicki M","Narayana B","Dutkiewicz G"],"additional_accession":[]},"is_claimable":false,"name":"(2E)-1-(4-Bromo-phen-yl)-3-(4-fluoro-phen-yl)prop-2-en-1-one.","description":"The title compound, C(15)H(10)BrFO, is isostructural with (2E)-1-(4-chloro-phen-yl)-3-(4-fluoro-phen-yl)prop-2-en-1-one [Qiu et al. (2006 ▶). Acta Cryst. E62, o3525-o3526], but the structures of other dihalogen analogues, without fluorine, are different, although they are also isostructural within the series. The mol-ecule is approximately flat, the dihedral angle between the ring planes being 8.49 (13)°. In the crystal structure, inter-molecular C-H⋯O, C-H⋯F and C-H⋯Br hydrogen bonds link mol-ecules into V-shaped ribbons running parallel to [101] and stacked with an inter-planar distance of approximately 3.53 Å (centroid-vcentroid distance = 3.857 Å)..","dates":{"release":"2010-01-01T00:00:00Z","publication":"2010 Apr","modification":"2025-04-04T14:42:29.735Z","creation":"2019-03-27T00:00:55Z"},"accession":"S-EPMC2979273","cross_references":{"pubmed":["21579262"],"doi":["10.1107/S1600536810015485"]}}