Information card for entry 4341161

Structure parameters

• Formula: B6 Cl Na2 O10 Rb
• Calculated formula: B6 Cl Na2 O10 Rb
• Title of publication: Effect of halogen (cl, br) on the symmetry of flexible perovskite-related framework.
• Authors of publication: Bai, Chunyan; Yu, Hongwei; Han, Shujuan; Pan, Shilie; Zhang, Bingbing; Wang, Ying; Wu, Hongping; Yang, Zhihua
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 20
• Pages of publication: 11213 - 11220
• a: 8.3251 ± 0.0003 Å
• b: 9.6543 ± 0.0003 Å
• c: 12.7544 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1025.11 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No