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3-({4-[(2-Methylbenzylidene)amino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl}methyl)-1,3-benzoxazol-2(3H)-one

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dc.contributor.authorAydn A.
dc.contributor.authorHekimoğlu N.
dc.contributor.authorAkkurt M.
dc.contributor.authorÖnkol T.
dc.contributor.authorÇiçekli S.U.
dc.contributor.authorBüyükgüngör, Orhan
dc.date.accessioned2026-01-02T22:55:54Z
dc.date.issued2013-01-04
dc.description.abstractIn the title compound, C18H15N5O2S, a weak intramolecular C—H...S hydrogen bond results in a small dihedral angle of 3.71 (9)° between the methylphenyl and triazole rings, which, in turn, form dihedral angles of 80.09 (8) and 77.32 (8)°, respectively, with the benzoxazolone mean plane. In the crystal, N—H...O hydrogen bonds link molecules into chains along [001], and weak C—H...N hydrogen bonds and π–π interactions between the five- and six-membered rings [centroid–centroid distances = 3.5074 (11) and 3.616 (1) Å] consolidate the crystal packing.
dc.description.urihttps://doi.org/10.1107/s1600536812051458
dc.description.urihttps://journals.iucr.org/e/issues/2013/02/00/cv5375/cv5375.pdf
dc.description.urihttps://pubmed.ncbi.nlm.nih.gov/23424456
dc.description.urihttp://dx.doi.org/10.1107/S1600536812051458
dc.description.urihttps://doaj.org/article/2b34eeb7c32b457897054ebe84228706
dc.description.urihttps://dx.doi.org/10.1107/s1600536812051458
dc.description.urihttps://avesis.erciyes.edu.tr/publication/details/d321eed4-76d0-4b53-a476-d271574a1a46/oai
dc.description.urihttps://doi.org/10.1107/S1600536812051458
dc.description.urihttps://hdl.handle.net/20.500.12712/4997
dc.identifier.doi10.1107/s1600536812051458
dc.identifier.eissn1600-5368
dc.identifier.endpageo170
dc.identifier.openairedoi_dedup___::823b318fc9a958a0b945280b86628be9
dc.identifier.pubmed23424456
dc.identifier.scopus2-s2.0-84873353723
dc.identifier.startpageo169
dc.identifier.urihttps://hdl.handle.net/20.500.12597/35671
dc.identifier.volume69
dc.publisherInternational Union of Crystallography (IUCr)
dc.relation.ispartofActa Crystallographica Section E Structure Reports Online
dc.rightsOPEN
dc.subjectmean ?(C-C) = 0.003 Å
dc.subjectdata-to-parameter ratio = 16.7
dc.subjectwR factor = 0.110
dc.subjectT = 296 K
dc.subjectCrystallography
dc.subjectQD901-999
dc.subjectsingle-crystal X-ray study
dc.subjectOrganic Papers
dc.subjectR factor = 0.042
dc.title3-({4-[(2-Methylbenzylidene)amino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl}methyl)-1,3-benzoxazol-2(3H)-one
dc.typeArticle
dspace.entity.typePublication
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