Information card for entry 6000695

Structure parameters

• Formula: Ca H1.2 O4.6 S
• SMILES: [Ca+2].S(=O)(=O)([O-])[O-].O
• Title of publication: Investigation of the crystal-structure of gamma-CaSO4, CaSO4.0.5 H2O, and CaSO4.0.6 H2O by powder diffraction methods
• Authors of publication: Bezou, C.; Nonat, A.; Mutin, J. C.; Christensen, A. N.; Lehmann, M. S.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 1995
• Journal volume: 117
• Pages of publication: 165 - 176
• a: 11.9845 Å
• b: 6.9292 Å
• c: 12.7505 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1058.84 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: I 1 2 1
• Has coordinates: No
• Has disorder: No
• Has Fobs: No