Publication:
3-({4-[(2-Methyl-benzyl-idene)amino]-5-sulfanyl-idene-1H-1,2,4-triazol-3-yl}meth-yl)-1,3-benzoxazol-2(3H)-one.

dc.contributor.authorAydın, Abdullah, Hekimoğlu, Nuray, Akkurt, Mehmet, Onkol, Tijen, Ciçekli, Sölen Urlu, Büyükgüngör, Orhan
dc.date.accessioned2023-05-09T18:28:01Z
dc.date.available2023-05-09T18:28:01Z
dc.date.issued2013-02-01T00:00:00Z
dc.description.abstractIn the title compound, C(18)H(15)N(5)O(2)S, a weak intra-molecular C-H⋯S hydrogen bond results in a small dihedral angle of 3.71 (9)° between the methyl-phenyl 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 mol-ecules into chains along [001], and weak C-H⋯N hydrogen bonds and π-π inter-actions between the five- and six-membered rings [centroid-centroid distances = 3.5074 (11) and 3.616 (1) Å] consolidate the crystal packing.
dc.identifier.doi10.1107/S1600536812051458
dc.identifier.pubmed23424456
dc.identifier.scopus2-s2.0-84873353723
dc.identifier.urihttps://hdl.handle.net/20.500.12597/13325
dc.relation.ispartofActa Crystallographica Section E: Structure Reports Online
dc.rightstrue
dc.subjectdata-to-parameter ratio = 16.7 | mean σ(C-C) = 0.003 Å | R factor = 0.042 | single-crystal X-ray study | T = 296 K | wR factor = 0.110
dc.title3-({4-[(2-Methyl-benzyl-idene)amino]-5-sulfanyl-idene-1H-1,2,4-triazol-3-yl}meth-yl)-1,3-benzoxazol-2(3H)-one.
dc.typeJournal Article
dspace.entity.typePublication
oaire.citation.issue2
oaire.citation.volume69
relation.isPubmedOfPublication0105476d-e811-4892-986a-3e94ed4d83dd
relation.isPubmedOfPublication.latestForDiscovery0105476d-e811-4892-986a-3e94ed4d83dd
relation.isScopusOfPublication0872f42d-f985-4dbf-a3a6-6bbc1216255a
relation.isScopusOfPublication.latestForDiscovery0872f42d-f985-4dbf-a3a6-6bbc1216255a

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