Information card for entry 2240885

Structure parameters

• Chemical name: <i>catena</i>-Poly[[tetraaquamagnesium]-μ-(dihydrogen hypodiphosphato)-κ^2^<i>O</i>:<i>O</i>']
• Formula: H10 Mg O10 P2
• Calculated formula: H10 Mg O10 P2
• SMILES: P(=O)(O[Mg]([OH2])([OH2])(OP(=O)(O)P(=O)(O[Mg]([OH2])([OH2])([OH2])[OH2])O)([OH2])[OH2])(O)P(=O)([O-])O
• Title of publication: Crystal structure of <i>catena</i>-poly[[tetraaquamagnesium]-μ-(dihydrogen hypodiphosphato)-κ^2^<i>O</i>:<i>O</i>']
• Authors of publication: Gjikaj, Mimoza; Haase, Madeline
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 7
• Pages of publication: 867 - 869
• a: 5.1486 ± 0.0015 Å
• b: 6.595 ± 0.002 Å
• c: 7.096 ± 0.002 Å
• α: 112.31 ± 0.02°
• β: 98.55 ± 0.02°
• γ: 98.28 ± 0.02°
• Cell volume: 215.08 ± 0.12 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes