The title compound, C 28 H 24 N 6 O 4 , crystallizes with one halfmolecule in the asymmetric unit, the other half being generated by a center of inversion. In the crystal structure, molecules are linked into ribbons along the a axis by weak C-HÁ Á ÁN hydrogen bonds.
Dimethyl 5-(4-phenyl-1H-1,2,3-triazol-1-yl)benzene-1,3-dicarboxylate
✍ Scribed by Zou, Wen-Qiang ;Li, Yan ;Zheng, Fa-Kun ;Guo, Guo-Cong ;Huang, Jin-Shun
- Publisher
- International Union of Crystallography
- Year
- 2006
- Tongue
- English
- Weight
- 218 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
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.
Single-crystal X-ray study T = 295 K Mean '(C±C) = 0.003 A Ê R factor = 0.034 wR factor = 0.084 Data-to-parameter ratio = 12.8 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
In the title compound, C 11 H 9 N 5 OS, the molecules are linked into chains along the c axis via N-HÁ Á ÁN hydrogen bonds. The packing is further stabilized by C-HÁ Á Á andinteractions.