Information card for entry 1562273

Structure parameters

• Formula: B Cu2 H3 O10 P2
• Calculated formula: B Cu2 H3 O10 P2
• Title of publication: The molten hydrated flux synthesis of a novel open-framework copper borophosphate and its structural relation with the precursors
• Authors of publication: Zhao, Long; Liu, Wei; Ma, Xiaohong; Cao, Lixin; Su, Ge; Lu, Zhisheng
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2014
• Journal volume: 218
• Pages of publication: 10 - 14
• a: 8.234 Å
• b: 9.655 Å
• c: 17.805 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1415.48 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No