Information card for entry 2226730

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(4-sulfamoylphenyl)acetamide
• Formula: C8 H9 Cl N2 O3 S
• Calculated formula: C8 H9 Cl N2 O3 S
• SMILES: ClCC(=O)Nc1ccc(cc1)S(=O)(=O)N
• Title of publication: 2-Chloro-<i>N</i>-(4-sulfamoylphenyl)acetamide
• Authors of publication: Akkurt, Mehmet; Yalçın, Şerife Pınar; Türkmen, Hasan; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1596
• a: 4.787 ± 0.0002 Å
• b: 14.1868 ± 0.0009 Å
• c: 16.0158 ± 0.0009 Å
• α: 90°
• β: 90.907 ± 0.004°
• γ: 90°
• Cell volume: 1087.53 ± 0.1 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.0537
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1261
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes