Information card for entry 2225828

Structure parameters

• Chemical name: Bis[(1-ammonioethane-1,1-diyl)diphosphonato- κ^2^<i>O</i>,<i>O</i>']diaquanickel(II) nonahydrate
• Formula: C4 H38 N2 Ni O23 P4
• Calculated formula: C4 H38 N2 Ni O23 P4
• Title of publication: Bis[(1-ammonioethane-1,1-diyl)diphosphonato-κ^2^<i>O</i>,<i>O</i>']diaquanickel(II) nonahydrate
• Authors of publication: Bon, Vladimir V.; Dudko, Anatolij V.; Kozachkova, Alexandra N.; Pekhnyo, Vasily I.; Tsaryk, Natalia V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m591 - m592
• a: 15.1408 ± 0.0003 Å
• b: 13.1972 ± 0.0003 Å
• c: 12.9344 ± 0.0003 Å
• α: 90°
• β: 106.169 ± 0.0011°
• γ: 90°
• Cell volume: 2482.27 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0355
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes