Information card for entry 2239027

Structure parameters

• Common name: Barium polyphosphate
• Chemical name: Barium <i>catena</i>-polyphosphate
• Formula: Ba O6 P2
• Calculated formula: Ba O6 P2
• Title of publication: Redetermination of β-Ba(PO~3~)~2~
• Authors of publication: Weil, Matthias
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 2
• Pages of publication: i7
• a: 4.4979 ± 0.0002 Å
• b: 8.3377 ± 0.0004 Å
• c: 13.3911 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 502.19 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.0473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes