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2-(2,4-Di­chloro­phenyl)-1-(1H-1,2,4-triazol-1-yl)­hexan-2-ol (hexaconazole)

✍ Scribed by Chopra, Deepak ;Mohan, T. P. ;Rao, K. S. ;Guru Row, T. N.

Publisher
International Union of Crystallography
Year
2004
Tongue
English
Weight
289 KB
Volume
60
Category
Article
ISSN
1600-5368

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In the title compound, C 16 H 12 N 6 OÁ0.5C 6 H 12 , the disordered molecule of cyclohexane lies on a centre of symmetry. In the crystal structure, molecules are linked into double chains along the b axis by intermolecular C-HÁ Á ÁN interactions. The packing is further stabilized by C-HÁ Á Á andinte

2-Amino-4-(2,5-di­chloro­phenyl)-5-(1H-1
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Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.003 A Ê R factor = 0.026 wR factor = 0.062 Data-to-parameter ratio = 12.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.

Bis­[4-phenyl-5-(1H-1,2,4-triazol-3-yl)-
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The title compound, C 20 H 14 N 12 S 2 , was synthesized by the reaction of 3-hydrazino-1H-1,2,4-triazole with phenyl isocyanate in benzene and by ring closure in an alkaline medium. Intermolecular N-HÁ Á ÁN hydrogen bonds are observed and these form a five-membered ring.