Information card for entry 4337879

Structure parameters

• Formula: C57 H80 Fe2 N24 Ni3 O7
• Calculated formula: C57 H80 Fe2 N24 Ni3 O7
• Title of publication: 1D to 3D Heterobimetallic Complexes Tuned by Cyanide Precursors: Synthesis, Crystal Structures, and Magnetic Properties.
• Authors of publication: Zhang, Daopeng; Si, Weijiang; Wang, Ping; Chen, Xia; Jiang, Jianzhuang
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3494
• a: 11.226 ± 0.0016 Å
• b: 16.255 ± 0.002 Å
• c: 19.936 ± 0.003 Å
• α: 98.772 ± 0.002°
• β: 91.718 ± 0.002°
• γ: 105.78 ± 0.002°
• Cell volume: 3450.1 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0898
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1769
• Weighted residual factors for all reflections included in the refinement: 0.1964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No