Unknown

Dataset Information

0

1-[4-(Difluoromethoxy)phenyl]-N-(2,3-dimethylphenyl)-1H-1,2,4-triazole-3-carboxamide.

ABSTRACT: In the mol-ecule of the title compound, C(18)H(16)F(2)N(4)O(2), the 1,2,4-triazole ring forms dihedral angles of 3.6?(2) and 14.9?(6)° with the 4-difluoro-meth-oxy-substituted benzene ring and the 2,3-dimethyl-substituted benzene ring, respectively. The OCHF(2) group is twisted away from the plane of the benzene ring, as shown by the C-O-C-C torsion angle of 145.8?(2)°. The conformation is stabilized by an inter-molecular N-H?N hydrogen bond. In the crystal, short C-H?O inter-actions lead to chains of mol-ecules.

SUBMITTER: Wang YG 

PROVIDER: S-EPMC2977702 | biostudies-literature | 2009 Apr

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

1-[4-(Difluoromethoxy)phenyl]-N-(2,3-dimethylphenyl)-1H-1,2,4-triazole-3-carboxamide.

Wang Yu-Guang YG   Huang Guo-Bo GB   Zhu Bing-Chun BC  

Acta crystallographica. Section E, Structure reports online 20090410 Pt 5

In the mol-ecule of the title compound, C(18)H(16)F(2)N(4)O(2), the 1,2,4-triazole ring forms dihedral angles of 3.6 (2) and 14.9 (6)° with the 4-difluoro-meth-oxy-substituted benzene ring and the 2,3-dimethyl-substituted benzene ring, respectively. The OCHF(2) group is twisted away from the plane of the benzene ring, as shown by the C-O-C-C torsion angle of 145.8 (2)°. The conformation is stabilized by an inter-molecular N-H⋯N hydrogen bond. In the crystal, short C-H⋯O inter-actions lead to cha  ...[more]

Similar Datasets

Unknown 1H-1,2,4-Triazole-3-carboxamide.
| S-EPMC2961543 | biostudies-literature
Unknown 5-Amino-3-methyl-1-phenyl-1H-1,2,4-triazole.
| S-EPMC2961023 | biostudies-literature
Unknown 1-[2-(2,4-Dichloro-phenyl)-pent-yl]-1H-1,2,4-triazole.
| S-EPMC2969042 | biostudies-literature
Unknown 4-Amino-3-phenyl-1H-1,2,4-triazole-5(4H)-thione.
| S-EPMC2961480 | biostudies-literature
Unknown 7-Chloro-3-phenyl-benzo[4,5]thia-zolo[2,3-c][1,2,4]triazole.
| S-EPMC3201329 | biostudies-literature
Unknown 3-Nitro-1H-1,2,4-triazole.
| S-EPMC3050167 | biostudies-literature
Unknown 4-[(E)-2-Furylmethyl-eneamino]-3-phenyl-1H-1,2,4-triazole-5(4H)-thione.
| S-EPMC2962152 | biostudies-literature
Unknown 3-[(4-Phen-oxy-phen-yl)sulfan-yl]-5-phenyl-1H-1,2,4-triazole.
| S-EPMC4011301 | biostudies-literature
Unknown 4-{[(E)-(3-Phenyl-1H-pyrazol-4-yl)methyl-idene]amino}-1H-1,2,4-triazole-5(4H)-thione.
| S-EPMC3212330 | biostudies-literature
Unknown N-[(E)-Morpholin-4-yl-methyl-idene]-1-phenyl-1H-1,2,4-triazole-3,5-diamine monohydrate.
| S-EPMC3011646 | biostudies-literature