Information card for entry 1100083

Structure parameters

• Chemical name: Magnesium sulfite hexahydrate
• Formula: H12 Mg O9 S
• Calculated formula: H12 Mg O9 S
• SMILES: [Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].S(=O)([O-])[O-]
• Title of publication: Deformation density in magnesium sulfite hexahydrate
• Authors of publication: Bats, J. W.; Fuess, H.; Elerman, Y.
• Journal of publication: Acta Crystallographica B (39,1983-)
• Year of publication: 1986
• Journal volume: 42
• Journal issue: 6
• Pages of publication: 552 - 557
• a: 5.911 ± 0.001 Å
• b: 5.911 ± 0.001 Å
• c: 5.911 ± 0.001 Å
• α: 96.25 ± 0.02°
• β: 96.25 ± 0.02°
• γ: 96.25 ± 0.02°
• Cell volume: 202.6 ų
• Number of distinct elements: 4
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :R
• Hall space group symbol: P 3*
• Residual factor for all reflections: 0.017
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No