Information card for entry 7130544

Structure parameters

• Formula: B6 Ba2 O13 Zn2
• Calculated formula: B6 Ba2 O13 Zn2
• Title of publication: Ba2Zn2B6O13: Coplanar [B2O5] in Unnoted U-Shaped [B6O13] Groups Achieving Large Birefringence
• Authors of publication: Zhang, Rui; Su, Xin; Zhang, Jie; Wen, Dulin; Huang, Yi-Neng
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 6.9742 ± 0.0004 Å
• b: 7.0347 ± 0.0004 Å
• c: 13.2993 ± 0.0008 Å
• α: 93.645 ± 0.002°
• β: 99.323 ± 0.002°
• γ: 119.262 ± 0.002°
• Cell volume: 553.93 ± 0.06 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No