Information card for entry 2015342

Structure parameters

• Common name: diammonium trimagnesium hydrogenophosphite hexahydrate
• Chemical name: Bis(ammonium) tris(hexaaquamagnesium) tetrakis(hydrogen phosphite)
• Formula: H48 Mg3 N2 O30 P4
• Calculated formula: H48 Mg3 N2 O30 P4
• SMILES: P(=O)([O-])[O-].P(=O)([O-])[O-].P(=O)([O-])[O-].P(=O)([O-])[O-].[Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[NH4+].[NH4+]
• Title of publication: Bis(ammonium) tris(hexaaquamagnesium) tetrakis(hydrogen phosphite)
• Authors of publication: Abdallah, Khaoulani Idrissi; Mohamed, Saadi; Mohamed, Rafiq; Abdelhalim, Guelzim
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: i43 - i45
• a: 34.364 ± 0.009 Å
• b: 7.045 ± 0.002 Å
• c: 6.1736 ± 0.0017 Å
• α: 90°
• β: 91.349 ± 0.004°
• γ: 90°
• Cell volume: 1494.2 ± 0.7 ų
• Cell temperature: 289 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes