Information card for entry 2018005

Structure parameters

• Chemical name: Copper(II) manganese(II) orthophosphate
• Formula: Cu0.5 Mn2.5 O8 P2
• Calculated formula: Cu0.5 Mn2.5 O8 P2
• Title of publication: Copper(II) manganese(II) orthophosphate, Cu~0.5~Mn~2.5~(PO~4~)~2~
• Authors of publication: Bond, Andrew D.; Foghmoes, Søren P. V.; Warner, Terence E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: i21 - i23
• a: 8.8428 ± 0.0003 Å
• b: 11.5331 ± 0.0004 Å
• c: 6.0539 ± 0.0002 Å
• α: 90°
• β: 98.712 ± 0.002°
• γ: 90°
• Cell volume: 610.28 ± 0.04 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0202
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0493
• Weighted residual factors for all reflections included in the refinement: 0.0497
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes