Information card for entry 2207063

Structure parameters

• Chemical name: Propane 1,2-diaminium hydrogenarsenate
• Formula: C3 H13 As N2 O4
• Calculated formula: C3 H13 As N2 O4
• Title of publication: Propane-1,2-diaminium hydrogenarsenate
• Authors of publication: Todd, Malcolm J.; Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: m2026 - m2028
• a: 10.9568 ± 0.0004 Å
• b: 6.4297 ± 0.0003 Å
• c: 11.5999 ± 0.0005 Å
• α: 90°
• β: 104.816 ± 0.002°
• γ: 90°
• Cell volume: 790.03 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes