Information card for entry 2243516

Structure parameters

• Chemical name: Sodium manganese indium tris(phosphate) (2.22/0.87/1.68)
• Formula: In1.68 Mn0.87 Na2.22 O12 P3
• Calculated formula: In1.6886 Mn0.8552 Na2.2238 O12 P3
• Title of publication: Synthesis, crystal structure and charge-distribution validation of a new alluaudite-type phosphate, Na~2.22~Mn~0.87~In~1.68~(PO~4~)~3~
• Authors of publication: Badri, Abdessalem; Alvarez-Serrano, Inmaculada; Luisa López, María; Ben Amara, Mongi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 8
• Pages of publication: 1369 - 1372
• a: 12.412 ± 0.002 Å
• b: 12.855 ± 0.002 Å
• c: 6.599 ± 0.001 Å
• α: 90°
• β: 114.727 ± 0.002°
• γ: 90°
• Cell volume: 956.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0215
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0534
• Weighted residual factors for all reflections included in the refinement: 0.0535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.308
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes