Information card for entry 2241800

Structure parameters

• Chemical name: Calcium dizinc iron(III) tris(orthophosphate)
• Formula: Ca Fe O12 P3 Zn2
• Calculated formula: Ca Fe O12 P3 Zn2
• Title of publication: Synthesis and crystal structure of calcium dizinc iron(III) tris(orthophosphate), CaZn~2~Fe(PO~4~)~3~
• Authors of publication: Khmiyas, Jamal; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 9
• Pages of publication: 1260 - 1262
• a: 8.5619 ± 0.0003 Å
• b: 15.2699 ± 0.0005 Å
• c: 8.119 ± 0.0003 Å
• α: 90°
• β: 117.788 ± 0.002°
• γ: 90°
• Cell volume: 939.06 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0211
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.0401
• Weighted residual factors for all reflections included in the refinement: 0.0412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes