Information card for entry 4331913

Structure parameters

• Formula: C H3 Cs Fe O10 P2
• Calculated formula: C H3 Cs Fe O10 P2
• Title of publication: Ionic Liquid of Choline Chloride/Malonic Acid as a Solvent in the Synthesis of Open-Framework Iron Oxalatophosphates
• Authors of publication: Sheu, Chyi-Yang; Lee, Shang-Fan; Lii, Kwang-Hwa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 1891 - 1893
• a: 8.0038 ± 0.0003 Å
• b: 10.2923 ± 0.0003 Å
• c: 11.4755 ± 0.0004 Å
• α: 90°
• β: 100.507 ± 0.001°
• γ: 90°
• Cell volume: 929.47 ± 0.05 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.0437
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No