Information card for entry 4311361

Structure parameters

• Formula: C46 H34 Fe2 Mn N2 O4
• Calculated formula: C46 H34 Fe2 Mn N2 O4
• Title of publication: Novel One-Dimensional Polymers Generated from p-Ferrocenylbenzoate: Syntheses, Structures, and Magnetic Properties
• Authors of publication: Hongwei Hou; Linke Li; Yu Zhu; Yaoting Fan; Yuqin Qiao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4767 - 4774
• a: 20.889 ± 0.004 Å
• b: 21.666 ± 0.004 Å
• c: 8.2232 ± 0.0016 Å
• α: 90°
• β: 95.16 ± 0.03°
• γ: 90°
• Cell volume: 3706.6 ± 1.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0666
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0645
• Weighted residual factors for all reflections included in the refinement: 0.0689
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No