Information card for entry 2222029

Structure parameters

• Chemical name: 2-(Benzenesulfonamido)pyridinium perchlorate
• Formula: C11 H11 Cl N2 O6 S
• Calculated formula: C11 H11 Cl N2 O6 S
• SMILES: S(=O)(=O)(Nc1[nH+]cccc1)c1ccccc1.Cl(=O)(=O)(=O)[O-]
• Title of publication: 2-(Benzenesulfonamido)pyridinium perchlorate
• Authors of publication: Li, Xun; Xie, Dan; Xiao, Zhi-Hong; Li, Chang-Zhu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1430
• a: 5.6594 ± 0.0011 Å
• b: 7.5996 ± 0.0015 Å
• c: 16.157 ± 0.003 Å
• α: 83.21 ± 0.03°
• β: 83.7 ± 0.03°
• γ: 73.84 ± 0.03°
• Cell volume: 660.6 ± 0.2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.0924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes