The title compound, C 14 H 12 OS, crystallizes with the two independent molecules in the asymmetric unit. All bond lengths and angles in both molecules show normal values. No intermolecular hydrogen bonds or short contacts are found in the crystal structure.
1-(2,4-Dichlorophenyl)-3-(2-thienyl)prop-2-en-1-one
✍ Scribed by Ng, Shea-Lin ;Razak, Ibrahim Abdul ;Fun, Hoong-Kun ;Patil, P. S. ;Dharmaprakash, S. M.
- Publisher
- International Union of Crystallography
- Year
- 2006
- Tongue
- English
- Weight
- 419 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
Single-crystal X-ray study T = 100 K Mean (C-C) = 0.001 A Disorder in main residue R factor = 0.029 wR factor = 0.075 Data-to-parameter ratio = 40.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
The thiophene ring of the title compound, C 13 H 9 NO 3 S, is disordered. An approximate 180 rotation of the thiophene ring with respect to the central C-C single bond is observed in the molecule.
The title compound, C~16~H~12~Cl~2~O, exhibits second-order nonlinear optical properties as it crystallizes in a non-centrosymmetric space group. The dihedral angle between the benzene rings is 34.02 (6)°. Intermolecular C—H...O interactions link the molecules to form chains along the __c__ axis.
In the title molecule, C 17 H 14 Cl 2 O 3 , the methoxy groups are almost coplanar with the attached benzene ring. The molecules are linked via intermolecular C-HÁ Á ÁO interactions into wave-like chains along the b axis.