Information card for entry 2228409

Structure parameters

• Chemical name: 2,4-Dichloro-<i>N</i>-(1,3-thiazol-2-yl)benzamide
• Formula: C10 H6 Cl2 N2 O S
• Calculated formula: C10 H6 Cl2 N2 O S
• SMILES: Clc1c(C(=O)Nc2sccn2)ccc(Cl)c1
• Title of publication: 2,4-Dichloro-<i>N</i>-(1,3-thiazol-2-yl)benzamide
• Authors of publication: Saeed, Sohail; Rashid, Naghmana; Wong, Wing-Tak
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3078
• a: 14.054 ± 0.003 Å
• b: 13.063 ± 0.003 Å
• c: 6.288 ± 0.0014 Å
• α: 90°
• β: 101.578 ± 0.003°
• γ: 90°
• Cell volume: 1130.9 ± 0.4 ų
• Cell temperature: 304 ± 2 K
• Ambient diffraction temperature: 304 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes