Information card for entry 1100080

Structure parameters

• Chemical name: Magnesium sulfate(IV) 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: Neutron Diffraction Refinement of Magnesium Sulfite Hexahydrate, MgSO~3~.(H~2~O)~6~
• Authors of publication: Anderson, L.; Lindquist, O.
• Journal of publication: Acta Crystallographica, Section C: Crystal Structure Communications
• Year of publication: 1984
• Journal volume: 40
• Journal issue: 4
• Pages of publication: 584 - 586
• a: 5.933 ± 0.002 Å
• b: 5.933 ± 0.002 Å
• c: 5.933 ± 0.002 Å
• α: 96.28 ± 0.02°
• β: 96.28 ± 0.02°
• γ: 96.28 ± 0.02°
• Cell volume: 204.8 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: 0.036
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No