Information card for entry 8103054

Structure parameters

• Formula: B8 Ca6.6 Cd1.4 O20
• Calculated formula: B8 Ca6.6 Cd1.4 O20
• Title of publication: Crystal structure of calcium cadmium borate, Ca6.6Cd1.4(B2O5)4
• Authors of publication: Zhi-Wei Jiao; De-Zhong Shen; Ru-Ji Wang; Guang-Qiu Shen; Xiao-Qing Wang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 4
• Pages of publication: 623
• a: 7.1306 ± 0.0018 Å
• b: 5.1843 ± 0.0007 Å
• c: 11.484 ± 0.003 Å
• α: 90°
• β: 92.57 ± 0.03°
• γ: 90°
• Cell volume: 424.1 ± 0.16 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0476
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No