Information card for entry 2220383

Structure parameters

• Chemical name: Pentasodium ammonium trimanganese(II) borophosphate sesquihydrate
• Formula: B18 H20 Mn6 N2 Na10 O75 P12
• Calculated formula: B18 H6 Mn6 N2 Na10 O75 P12
• Title of publication: Na~5~(NH~4~)Mn~3~[B~9~P~6~O~33~(OH)~3~]·1.5H~2~O
• Authors of publication: Lin, Zhi-Sheng; Huang, Ya-Xi; Prots, Yurii; Zhao, Jing-Tai; Kniep, Rüdiger
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: i82 - i83
• a: 11.9331 ± 0.0002 Å
• b: 11.9331 ± 0.0002 Å
• c: 12.129 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1495.76 ± 0.06 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 7
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0412
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes