Information card for entry 2204221

Structure parameters

• Formula: C4 H15 N2 O4 P
• Calculated formula: C4 H15 N2 O4 P
• Title of publication: Piperizinium hydrogen phosphite monohydrate
• Authors of publication: Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 9
• Pages of publication: o1577 - o1579
• a: 12.2476 ± 0.0008 Å
• b: 6.5706 ± 0.0004 Å
• c: 10.6592 ± 0.0008 Å
• α: 90°
• β: 92.744 ± 0.001°
• γ: 90°
• Cell volume: 856.81 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0557
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.1228
• Weighted residual factors for all reflections included in the refinement: 0.1308
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes