Information card for entry 2020133

Structure parameters

• Chemical name: Ca S O4 (H2 O).8
• Formula: Ca H1.6 O4.8 S
• Calculated formula: Ca H1.6 O4.8 S
• SMILES: [Ca][OH2].S(=O)(=O)([O-])[O-]
• Title of publication: Calcium Sulfat Subhydrat, Ca S O4 (H2 O).8
• Authors of publication: Abriel, W.
• Journal of publication: Acta Crystallographica C (39,1983-)
• Year of publication: 1983
• Journal volume: 39
• Pages of publication: 956 - 958
• a: 6.968 Å
• b: 6.968 Å
• c: 6.41 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 269.529 ų
• Number of distinct elements: 4
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No