Information card for entry 2227198

Structure parameters

• Chemical name: Bis(4-aminopyridinium) sulfate monohydrate
• Formula: C10 H16 N4 O5 S
• Calculated formula: C10 H16 N4 O5 S
• Title of publication: Bis(4-aminopyridinium) sulfate monohydrate
• Authors of publication: Quah, Ching Kheng; Fun, Hoong-Kun; Isloor, Arun M.; Isloor, Nishitha
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: o2250 - o2251
• a: 6.4434 ± 0.0001 Å
• b: 8.4153 ± 0.0001 Å
• c: 12.4488 ± 0.0002 Å
• α: 96.365 ± 0.001°
• β: 97.534 ± 0.001°
• γ: 95.387 ± 0.001°
• Cell volume: 661.022 ± 0.017 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0485
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes