Information card for entry 7062547

Structure parameters

• Common name: potassium bismuth oxophosphate
• Chemical name: potassium pentabismuth pentaoxo-diphosphate
• Formula: Bi2.5 K0.5 O6.5 P
• Calculated formula: Bi2.5 K0.5 O6.5 P
• Title of publication: Novel bismuth oxosalts, β-Bi3O3(VO4) and KBi5O5(PO4)2: synthesis and effect of hydrothermal pressure on the crystal structure
• Authors of publication: Shvanskaya, Larisa; Krikunova, Polina; Nikolaeva, Irina; Lyssenko, Konstantin; Pokryshkin, Nikolay; Timoshenko, Victor
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 29
• Pages of publication: 13911 - 13917
• a: 8.0264 ± 0.0006 Å
• b: 5.4616 ± 0.0004 Å
• c: 27.769 ± 0.002 Å
• α: 90°
• β: 95.697 ± 0.002°
• γ: 90°
• Cell volume: 1211.3 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0485
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No