Information card for entry 7701495

Structure parameters

• Formula: B4 H22 Mg O18
• Calculated formula: B4 H22 Mg O18
• Title of publication: Mg(H2O)6B4O5(OH)4(H2O)3: A new hydrated borate with a short DUV cutoff edge
• Authors of publication: Wang, Ya; Han, Jian; Guo, Fengjiao; Cheng, Shichao; Yang, Zhihua; Pan, Shilie
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 12.208 ± 0.004 Å
• b: 10.682 ± 0.004 Å
• c: 12.683 ± 0.005 Å
• α: 90°
• β: 114.953 ± 0.004°
• γ: 90°
• Cell volume: 1499.5 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• 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: 0.0789
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1143
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No