Information card for entry 4332097

Structure parameters

• Formula: C60 H84 B4 Fe4 Mn2 N40 O12
• Calculated formula: C60 H84 B4 Fe4 Mn2 N40 O12
• Title of publication: Synthesis, Structures, and Magnetic Properties of a Series of Cyano-Bridged Fe−Mn Bimetallic Complexes
• Authors of publication: Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu; Gao, Song
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 13
• Pages of publication: 5018 - 5026
• a: 13.609 ± 0.005 Å
• b: 14.672 ± 0.005 Å
• c: 23.23 ± 0.008 Å
• α: 90°
• β: 106.857 ± 0.007°
• γ: 90°
• Cell volume: 4439 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0766
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1239
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No