Pubmed:
Crystal structure and Hirshfeld surface analysis of 4-(4-chloro-phen-yl)-5-methyl-3-{4-[(2-methyl-phen-yl)meth-oxy]phen-yl}-1,2-oxazole.

dc.contributor.authorAydin, Abdullah
dc.contributor.authorAkkurt, Mehmet
dc.contributor.authorTuranli, Sumeyye
dc.contributor.authorLengerli, Deniz
dc.contributor.authorBanoglu, Erden
dc.contributor.authorOzcelik, Nefise Dilek
dc.date.accessioned2023-04-06T23:53:58Z
dc.date.available2023-04-06T23:53:58Z
dc.date.issued2021-04-01T00:00:00Z
dc.description.abstractIn the title compound, CHClNO, the mean planes of 4-chloro-phenyl, 2-methyl-phenyl and phenyl-ene rings make dihedral angles of 62.8 (2), 65.1 (3) and 15.1 (2)°, respectively, with the 5-methyl-1,2-oxazole ring. In the crystal, mol-ecules are linked by inter-molecular C-H⋯N, C-H⋯Cl, C-H⋯π contacts and π-π stacking inter-actions between the phenyl-ene groups. Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H⋯H (48.7%), H⋯C/C⋯H (22.2%), Cl⋯H/H⋯Cl (8.8%), H⋯O/O⋯H (8.2%) and H⋯N/N⋯H (5.1%) inter-actions.
dc.identifier.doi10.1107/S2056989021002383
dc.identifier.issn2056-9890
dc.identifier.pubmed33936755
dc.identifier.urihttps://hdl.handle.net/20.500.12597/3397
dc.language.isoen
dc.relation.ispartofActa crystallographica. Section E, Crystallographic communications
dc.subjectC—H⋯π inter­actions
dc.subjectHirshfeld surface analysis
dc.subjectcrystal structure
dc.subjectvicinal diaryl isoxazole
dc.titleCrystal structure and Hirshfeld surface analysis of 4-(4-chloro-phen-yl)-5-methyl-3-{4-[(2-methyl-phen-yl)meth-oxy]phen-yl}-1,2-oxazole.
dc.typeJournal Article
dspace.entity.typePubmed
oaire.citation.issuePt 4
oaire.citation.volume77
relation.isPublicationOfPubmed8d90b257-c813-437f-9976-9754621373c1
relation.isPublicationOfPubmed.latestForDiscovery8d90b257-c813-437f-9976-9754621373c1

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