Information card for entry 4313540

Structure parameters

• Formula: C10 H28 Fe0.5 N7 Ni O4
• Calculated formula: C10 H18 Fe0.5 N7 Ni O4
• Title of publication: Cyano-Bridged Homometallic 1-D and Bimetallic 2-D Assemblies: Synthesis, Structures, and Magnetic Properties of [Ni(baepn)(CN)]n(ClO4)n and [Ni(baepn)]2n[Fe(CN)6]n(H2O)8n
• Authors of publication: Ja-eung Koo; Do-hyeon Kim; Yaung-Soo Kim; Youngkyu Do
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2983 - 2987
• a: 8.951 ± 0.002 Å
• b: 13.672 ± 0.003 Å
• c: 14.392 ± 0.003 Å
• α: 90°
• β: 98.906 ± 0.004°
• γ: 90°
• Cell volume: 1740 ± 0.7 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: 0.0449
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1222
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No