Information card for entry 2216407

Structure parameters

• Chemical name: iron(II) monohydrate]
• Formula: C4 H10 Fe O8
• Calculated formula: C4 H10 Fe O8
• Title of publication: Poly[[diaqua-μ~3~-malonato-iron(II)] monohydrate]
• Authors of publication: Licai Zhu; Feng Sun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m2966 - m2966
• a: 14.2225 ± 0.0008 Å
• b: 8.2788 ± 0.0005 Å
• c: 14.7043 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1731.36 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes