Information card for entry 2226493

Structure parameters

• Chemical name: <i>N</i>-{[4-(4-Methoxybenzenesulfonamido)phenyl]sulfonyl}acetamide
• Formula: C15 H16 N2 O6 S2
• Calculated formula: C15 H16 N2 O6 S2
• SMILES: S(=O)(=O)(Nc1ccc(S(=O)(=O)NC(=O)C)cc1)c1ccc(OC)cc1
• Title of publication: <i>N</i>-{[4-(4-Methoxybenzenesulfonamido)phenyl]sulfonyl}acetamide
• Authors of publication: Mustafa, Ghulam; Akkurt, Mehmet; Khan, Islam Ullah; Naseem, Rahat; Sajjad, Beenish
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1768
• a: 5.3651 ± 0.001 Å
• b: 20.551 ± 0.003 Å
• c: 15.034 ± 0.002 Å
• α: 90°
• β: 94.04 ± 0.007°
• γ: 90°
• Cell volume: 1653.5 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.1789
• Residual factor for significantly intense reflections: 0.0838
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.1885
• Goodness-of-fit parameter for all reflections included in the refinement: 0.888
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes