Information card for entry 2001427

Structure parameters

• Formula: Br2 Ca H8 O12
• Calculated formula: Br2 Ca H8 O12
• Title of publication: Structure of tetraaquacalcium perbromate
• Authors of publication: Blackburn, A. C.; Gerkin, R. E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 8
• Pages of publication: 1439 - 1442
• a: 5.6218 ± 0.0009 Å
• b: 8.0058 ± 0.0007 Å
• c: 11.9924 ± 0.0016 Å
• α: 80.643 ± 0.009°
• β: 89.16 ± 0.012°
• γ: 89.75 ± 0.01°
• Cell volume: 532.5 ± 0.12 ų
• Cell temperature: 296 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.027
• Goodness-of-fit parameter for significantly intense reflections: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No