Information card for entry 2209018

Structure parameters

• Chemical name: 6-(4-Chlorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
• Formula: C10 H7 Cl N4 O2 S2
• Calculated formula: C10 H7 Cl N4 O2 S2
• SMILES: Clc1ccc(c2nc3n(nc(s3)S(=O)(=O)N)c2)cc1
• Title of publication: 6-(4-Chlorophenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole-2-sulfonamide
• Authors of publication: Anilkumar, G. N.; Kokila, M. K.; Puttaraja; Karki, S. S.; Kulkarni, M. V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: o2014 - o2016
• a: 7.469 ± 0.002 Å
• b: 18.64 ± 0.005 Å
• c: 9.156 ± 0.003 Å
• α: 90°
• β: 103.408 ± 0.005°
• γ: 90°
• Cell volume: 1240 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.042
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes