Information card for entry 2100942

Structure parameters

• Formula: O5 S Ti
• Calculated formula: O10 S2 Ti2
• SMILES: [Ti]=O.S(=O)(=O)([O-])[O-]
• Title of publication: Structure of anhydrous titanyl sulfate, titanyl sulfate monohydrate and prediction of a new structure
• Authors of publication: Gatehouse, B. M.; Platts, S. N.; Williams, T. B.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 428 - 435
• a: 10.942 ± 0.001 Å
• b: 5.158 ± 0.001 Å
• c: 25.726 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1451.9 ± 0.3 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P m m a
• Hall space group symbol: -P 2a 2a
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No