Information card for entry 1100085

Structure parameters

• Chemical name: Magnesium bis(hydrogensulfate) bis(sulfuric acid)
• Formula: H6 Mg O16 S4
• Calculated formula: H6 Mg O16 S4
• SMILES: [Mg+2].S(=O)(=O)(O)[O-].S(=O)(=O)(O)[O-].S(=O)(=O)(O)O.S(=O)(=O)(O)O
• Title of publication: Crystal structure of acid magnesium sulphate Mg:SO~3~(OH):~2~:SO~2~(OH)~2~:~2~
• Authors of publication: Troyanov, S I; Merinov, B V; Verin, I P; Kemnitz, E; Hass, D
• Journal of publication: Kristallografiya
• Year of publication: 1990
• Journal volume: 35
• Pages of publication: 852 - 855
• a: 5.091 ± 0.004 Å
• b: 15.329 ± 0.006 Å
• c: 7.882 ± 0.006 Å
• α: 90°
• β: 104.19 ± 0.06°
• γ: 90°
• Cell volume: 596.3 ų
• Number of distinct elements: 4
• 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: 0.061
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No