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.author | Aydın, Abdullah, Hekimoğlu, Nuray, Akkurt, Mehmet, Onkol, Tijen, Ciçekli, Sölen Urlu, Büyükgüngör, Orhan | |
dc.date.accessioned | 2023-05-09T18:28:01Z | |
dc.date.available | 2023-05-09T18:28:01Z | |
dc.date.issued | 2013-02-01T00:00:00Z | |
dc.description.abstract | In 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.doi | 10.1107/S1600536812051458 | |
dc.identifier.pubmed | 23424456 | |
dc.identifier.scopus | 2-s2.0-84873353723 | |
dc.identifier.uri | https://hdl.handle.net/20.500.12597/13325 | |
dc.relation.ispartof | Acta Crystallographica Section E: Structure Reports Online | |
dc.rights | true | |
dc.subject | data-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.title | 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.type | Journal Article | |
dspace.entity.type | Publication | |
oaire.citation.issue | 2 | |
oaire.citation.volume | 69 | |
relation.isPubmedOfPublication | 0105476d-e811-4892-986a-3e94ed4d83dd | |
relation.isPubmedOfPublication.latestForDiscovery | 0105476d-e811-4892-986a-3e94ed4d83dd | |
relation.isScopusOfPublication | 0872f42d-f985-4dbf-a3a6-6bbc1216255a | |
relation.isScopusOfPublication.latestForDiscovery | 0872f42d-f985-4dbf-a3a6-6bbc1216255a |