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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 C29H27ClN4O2       
Yazarlar
Prof. Dr. Abdullah AYDIN Prof. Dr. Abdullah AYDIN
Kastamonu Üniversitesi, Türkiye
Nuray Hekimoğlu
Mehmet Akkurt
Erciyes Üniversitesi, Türkiye
Tijen Önkol
Türkiye
Şölen Urlu Çiçekli
Orhan Büyükgüngör
Türkiye
Özet
In 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.
Anahtar Kelimeler
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
Makale Türü Özgün Makale
Makale Alt Türü ESCI dergilerinde yayımlanan tam makale
Dergi Adı ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS
Dergi ISSN 2056-9890
Dergi Tarandığı Indeksler ESCI
Makale Dili İngilizce
Basım Tarihi 02-2013
Cilt No 69
Sayı 2
Doi Numarası 10.1107/S1600536812051458
Makale Linki http://dx.doi.org/10.1107/s1600536812051458