Information card for entry 1563384

Structure parameters

• Formula: Al3 B4 Bi Cd3 O15
• Calculated formula: Al3 B4 Bi Cd3 O15
• Title of publication: Synthesis, crystal structure, spectrum properties, and electronic structure of a novel non-centrosymmetric borate, BiCd3(AlO)3(BO3)4
• Authors of publication: Chen, Xuean; Yin, Hui; Chang, Xinan; Zang, Hegui; Xiao, Weiqiang
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2010
• Journal volume: 183
• Journal issue: 12
• Pages of publication: 2910 - 2916
• a: 10.3919 ± 0.0015 Å
• b: 10.3919 ± 0.0015 Å
• c: 5.7215 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 535.09 ± 0.15 ų
• Cell temperature: 290 K
• Ambient diffraction temperature: 290 K
• Number of distinct elements: 5
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0319
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.0667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No