Information card for entry 4348977

Structure parameters

• Formula: B20 Ba2.5 Br O34 Rb4
• Calculated formula: B20 Ba2.5 Br O34 Rb4
• Title of publication: Effects of the Orientation of [B₅O₁₁]^7- Fundamental Building Blocks on Layered Structures Based on the Pentaborates.
• Authors of publication: Mutailipu, Miriding; Zhang, Min; Dong, Xiaoyu; Chen, Yanna; Pan, Shilie
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10608 - 10616
• a: 6.7321 ± 0.0004 Å
• b: 11.2428 ± 0.0008 Å
• c: 11.3074 ± 0.0008 Å
• α: 98.907 ± 0.004°
• β: 90.517 ± 0.004°
• γ: 100.83 ± 0.004°
• Cell volume: 829.81 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.063
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1413
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0376
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No