Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.004 A Ê R factor = 0.049 wR factor = 0.110 Data-to-parameter ratio = 15.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
1,6-Bis(1-methyl-1H-tetrazol-5-ylsulfanyl)hexane
✍ Scribed by She, Jiang-Bo ;Zhang, Guo-Fang ;Dou, Yin-Li ;Fan, Xue-Zhong ;Li, Ji-Zhen
- Publisher
- International Union of Crystallography
- Year
- 2006
- Tongue
- English
- Weight
- 165 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
The molecule of the title compound, C 10 H 18 N 8 S 2 , lies on a twofold rotation axis. Methyl C atoms contact N atoms of adjacent molecules through C-HÁ Á ÁN hydrogen bonds [3.445 (3) A ˚] in a molecular layer. In addition, the layers are linked by weak SÁ Á ÁS interactions [3.636 (3) A ˚].
📜 SIMILAR VOLUMES
The title compound, C 20 H 22 N 8 O 2 S 2 , contains a center of inversion at the mid-point of the central C-C bond. The mean planes of the phenyl and the 1H-tetrazol-5-ylsulfanyl rings make a dihedral angle of 53.95 (16) .
The title compound, C 16 H 18 S 2 (or L 6 ), crystallizes with two half-molecules in the asymmetric unit and each independent molecule lies about a crystallographic center of symmetry. The aliphatic segment of this ligand is in an all-trans conformation.