Information card for entry 4333591

Structure parameters

• Formula: C56 H48 F12 Fe2 N12 O12 S4
• Calculated formula: C56 H48 F12 Fe2 N12 O12 S4
• Title of publication: Syntheses and Electronic Structure of Bimetallic Complexes Containing a Flexible Redox-Active Bridging Ligand
• Authors of publication: Stacey Lindsay; Siu K. Lo; Oliver R. Maguire; Eckhard Bill; Michael R. Probert; Stephen Sproules; Corinna R. Hess
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 898 - 909
• a: 8.9929 ± 0.0011 Å
• b: 12.9736 ± 0.0018 Å
• c: 14.7541 ± 0.0016 Å
• α: 69.606 ± 0.004°
• β: 86.687 ± 0.005°
• γ: 76.892 ± 0.004°
• Cell volume: 1571 ± 0.3 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No