The title compound, C 19 H 18 N 2 O 4 S, was synthesized by the reaction of methyl (2-hydroxyphenyl)acetate and 3-(4-methylthio)phenyl-5-chloromethyl-1,2,4-oxadiazole. The structure exhibits intermolecular CÐHÁ Á ÁO hydrogen bonds and CÐ HÁ Á Á% interactions.
2-[(ρ-Methoxyphenylcarbonyl)(1,2,4-triazol-1-yl)methyl]sulfanyl-4,6-dimethylpyrimidine
✍ Scribed by Jian, Fangfang ;Xiao, Hailian ;Xu, Liangzhong
- Publisher
- International Union of Crystallography
- Year
- 2003
- Tongue
- English
- Weight
- 282 KB
- Volume
- 59
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.003 A Ê R factor = 0.045 wR factor = 0.125 Data-to-parameter ratio = 14.3 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
📜 SIMILAR VOLUMES
In the title compound, C 9 H 12 N 6 OS, the pyrazole and triazole rings are nearly coplanar, forming a dihedral angle of 6.50 (9) . There are N-HÁ Á ÁN intermolecular hydrogen-bond interactions in the crystal structure, providing stabilization.
Single-crystal X-ray study T = 183 K Mean '(C±C) = 0.002 A Ê Disorder in main residue R factor = 0.049 wR factor = 0.144 Data-to-parameter ratio = 16.2 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
The title compound, C 10 H 9 N 3 O 2 S, crystallizes in the orthorhombic non-centrosymmetric space group P2 1 2 1 2 1 . The molecules are linked into a three-dimensional network through OÐHÁ Á ÁN and NÐHÁ Á ÁO hydrogen bonds and weak SÁ Á ÁO interactions.