Information card for entry 7204651

Structure parameters

• Common name: Ammonium-(aqua(μ3-hydroxo)bis(μ4-phosphato)diferrate(iii))-hydrate
• Chemical name: Ammonium-[aqua(μ3-hydroxo)bis(μ4-phosphato)diferrate(III)]-hydrate
• Formula: Fe2 H9 N O11 P2
• Calculated formula: Fe2 H9 N O11 P2
• Title of publication: Open-framework iron phosphates: Syntheses, structures, sorption studies and oxidation catalysis
• Authors of publication: Abu-Shandi, Khalid; Winkler, Heiner; Wu, Biao; Janiak, Christoph
• Journal of publication: CrystEngComm
• Year of publication: 2003
• Journal volume: 5
• Journal issue: 33
• Pages of publication: 180 - 189
• a: 9.815 ± 0.002 Å
• b: 9.7225 ± 0.0019 Å
• c: 9.877 ± 0.002 Å
• α: 90°
• β: 102.87 ± 0.03°
• γ: 90°
• Cell volume: 918.8 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No