Crystal structure and Hirshfeld surface analysis of (2E)-1-(3-bromo­phen­yl)-3-(4-fluoro­phen­yl)prop-2-en-1-one

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dc.authorid0000-0002-1141-5151
dc.contributor.authorAtioğlu, Zeliha
dc.contributor.authorBindya, S.
dc.contributor.authorAkkurt, Mehmet
dc.contributor.authorKumar, C. S. Chidan
dc.date.accessioned2020-06-27T10:17:19Z
dc.date.available2020-06-27T10:17:19Z
dc.date.issued2019en_US
dc.departmentKapadokya Üniversitesi, Uygulamalı Bilimler Yüksekokulu, Havacılık Elektrik ve Elektroniği Bölümü
dc.descriptionTARAMAPUBMED
dc.descriptionTARAMASCOPUS
dc.descriptionTARAMAWOS
dc.description.abstractIn the title compound, C15H10BrFO, the mol­ecular structure consists of a 3-bromo­phenyl ring and a 4-fluoro­phenyl ring linked via a prop-2-en-1-one spacer. The 3-bromophenyl and 4-fluorophenyl rings make a dihedral angle of 48.90?(15)°. The mol­ecule has an E configuration about the C=C bond and the carbonyl group is syn with respect to the C=C bond. In the crystal, mol­ecules are linked by C—H?? inter­actions between the bromo­phenyl and fluoro­phenyl rings of mol­ecules, resulting in a two-dimensional layered structure parallel to the ab plane. The mol­ecular packing is stabilized by weak Br?H and F?H contacts, one of which is on the one side of each layer, and the second is on the other. The inter­molecular inter­actions in the crystal packing were further analysed using Hirshfeld surface analysis, which indicates that the most significant contacts are Cl?H/H?Cl (20.8%), followed by C?H/H?C (31.1%), H?H (21.7%), Br?H/H?Br (14.2%), F?H/H?F (9.8%), O?H/H?O (9.7%).
dc.identifier.citationATİOĞLU, Z., Bindya, S., AKKURT, M., & Chidan Kumar, C. S. (2019). Crystal structure and Hirshfeld surface analysis of 2E 1 3 bromo phen yl 3 4 fluoro phen yl prop 2 en 1 one. Acta Crystallographica Section E - CRYSTALLOGRAPHIC COMMUNICATIONS, 75(2), 146–149.
dc.identifier.doi10.1107/S2056989018018418
dc.identifier.endpage149en_US
dc.identifier.issn2056-9890
dc.identifier.issue2en_US
dc.identifier.scopusqualityQ3
dc.identifier.startpage146en_US
dc.identifier.urihttps://hdl.handle.net/20.500.12695/572
dc.identifier.urihttps://doi.org/10.1107/S2056989018018418
dc.identifier.volume75en_US
dc.identifier.wosqualityN/A
dc.indekslendigikaynakWeb of Sceince
dc.indekslendigikaynakScopus
dc.indekslendigikaynakPubMed
dc.institutionauthorAtioğlu, Zeliha
dc.language.isoen
dc.relation.ispartofActa Crystallographica Section E: Crystallographic Communications
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsAttribution-NonCommercial-ShareAlike 4.0 International*
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.rights.urihttps://creativecommons.org/licenses/by-nc-sa/4.0/*
dc.subjectCrystal structure
dc.subject3-bromophenylring
dc.subject4-fluorophenyl ring
dc.subjectA prop-2-en-1-onespacer
dc.subjectHirshfeld surface analysis
dc.titleCrystal structure and Hirshfeld surface analysis of (2E)-1-(3-bromo­phen­yl)-3-(4-fluoro­phen­yl)prop-2-en-1-one
dc.typeArticle

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