Information card for entry 2209400

Structure parameters

• Chemical name: Diammonium diaquapentanitratocerate(III) dihydrate
• Formula: Ce H16 N7 O19
• Calculated formula: Ce H10 N7 O19
• SMILES: [Ce]12345(ON(=[O]2)=O)([O]=N(=O)O4)([OH2])([O]=N(=[O]1)[O])(ON(=[O]3)=O)(ON(=[O]5)=O)[OH2].[NH4+].O.[NH4+].O
• Title of publication: Diammonium diaquapentanitratocerate(III) dihydrate
• Authors of publication: Mahdi Najafpour; Przemysław Starynowicz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: i145 - i146
• a: 11.089 ± 0.007 Å
• b: 8.936 ± 0.005 Å
• c: 17.963 ± 0.013 Å
• α: 90°
• β: 101.77 ± 0.06°
• γ: 90°
• Cell volume: 1743 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0275
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.0748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes