Information card for entry 7709298

Structure parameters

• Formula: B5 Ba2 H8 N O16
• Calculated formula: B5 Ba2 H8 N O16
• Title of publication: Ba₂B₅O₈(OH)₂(NO₃)·3H₂O: the design of an alkaline earth metal borate-nitrate optimized from a hydroxylic borate.
• Authors of publication: Hu, Huaiyu; Huang, Junben; Guo, Zhiyong; Zhang, Min; Yang, Zhihua; Pan, Shilie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 1979 - 1984
• a: 6.6406 ± 0.0006 Å
• b: 22.157 ± 0.002 Å
• c: 8.7863 ± 0.0006 Å
• α: 90°
• β: 101.98 ± 0.004°
• γ: 90°
• Cell volume: 1264.62 ± 0.18 ų
• Cell temperature: 301 K
• Ambient diffraction temperature: 301 K
• Number of distinct elements: 5
• 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: 0.0502
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No