(E)-2-[4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene]-2-(imidazol-1-yl)acetonitrile
✍ Scribed by Xiao, Tao ;Lin, Yuan ;Zhang, Xiao-Qing ;Chen, Jing ;Wang, Jin-Tang
- Publisher
- International Union of Crystallography
- Year
- 2006
- Tongue
- English
- Weight
- 139 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
In the molecule of the title compound, C 14 H 10 ClN 3 S 2 , the dithiolane ring adopts an envelope conformation. The intramolecular C-HÁ Á ÁCl hydrogen bond may be effective in the stabilization of the crystal structure.
📜 SIMILAR VOLUMES
In the title molecule, C 22 H 15 Cl 2 N 3 O 3 , the benzotriazole mean plane makes dihedral angles with the two benzene rings of 11.29 (1) and 84.90 (1) . Weak intermolecular C-HÁ Á ÁO hydrogen bonds link the molecules into chains extended along the b axis.
The geometrical parameters for the title compound, C 16 H 13 ClOS, are normal. The dihedral angle between the two benzene rings is 48.16 (5) . The non-centrosymmetric crystal packing is consistent with the substantial non-zero second harmonic generation response.
In the title compound, C 12 H 9 BrClN 3 O 3 , the nitro group lies in the plane of the imidazole ring, whereas the benzene and acetyl groups are markedly twisted relative to the heterocyclic ring. A weak C-HÁ Á ÁO interaction helps to establish the crystal packing.