Information card for entry 4307392

Structure parameters

• Formula: C18 H36 Cl2 Fe N O4
• Calculated formula: C18 H36 Cl2 Fe N O4
• Title of publication: Synthesis, Structure, and Magnetic Properties of (A)[FeIII(oxalate)Cl2] (A = Alkyl Ammonium Cations) with Anionic 1D [FeIII(oxalate)Cl2]- Chains
• Authors of publication: Hong-Bin Xu; Zhe-Ming Wang; Tao Liu; Song Gao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3089 - 3096
• a: 8.8836 ± 0.0004 Å
• b: 15.1939 ± 0.0008 Å
• c: 17.9685 ± 0.0012 Å
• α: 90°
• β: 91.556 ± 0.002°
• γ: 90°
• Cell volume: 2424.4 ± 0.2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2739
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 0.811
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No