Information card for entry 8102959

Structure parameters

• Formula: B Ca H3 Ni O10 P2
• Calculated formula: B Ca H3 Ni O10 P2
• Title of publication: Crystal structure of calcium nickel(II) (monohydrogen-monophosphate- dihydrogenmonoborate-monophosphate), CaNi[BP~2~O~7~(OH)~3~]
• Authors of publication: Menezes, P. W.; Hoffmann, S.; Prots, Yu.; Kniep, R.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 4
• Pages of publication: 429 - 430
• a: 10.2515 ± 0.0009 Å
• b: 8.3364 ± 0.0005 Å
• c: 9.1752 ± 0.0013 Å
• α: 90°
• β: 116.34 ± 0.04°
• γ: 90°
• Cell volume: 702.7 ± 0.3 ų
• Cell temperature: 295.15 K
• Ambient diffraction temperature: 295.15 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for all reflections included in the refinement: 0.0768
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No