Information card for entry 4332450

Structure parameters

• Formula: C8 H8 Fe3 Na2 O18 P2
• Calculated formula: C8 H2 Fe3 Na2 O18 P2
• Title of publication: Ionothermal Synthesis of Metal Oxalatophosphonates with a Three-Dimensional Framework Structure: Na2M3(C2O4)3(CH3PO3H)2(M = FeIIand MnII)
• Authors of publication: Tsao, Chun-Po; Sheu, Chyi-Yang; Nguyen, Ninh; Lii, Kwang-Hwa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6361 - 6364
• a: 5.8063 ± 0.0001 Å
• b: 10.3867 ± 0.0003 Å
• c: 14.8094 ± 0.0004 Å
• α: 90°
• β: 96.926 ± 0.001°
• γ: 90°
• Cell volume: 886.61 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0466
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No