Information card for entry 4316687

Structure parameters

• Formula: C48 H81 B Fe2 N2 P8
• Calculated formula: C48 H81 B Fe2 N2 P8
• Title of publication: Mixed-Valence Dinitrogen-Bridged Fe(0)/Fe(II) Complex
• Authors of publication: Leslie D. Field; Ruth W. Guest; Peter Turner
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9086 - 9093
• a: 15.833 ± 0.0003 Å
• b: 17.654 ± 0.0004 Å
• c: 19.739 ± 0.0004 Å
• α: 90°
• β: 94.014 ± 0.0012°
• γ: 90°
• Cell volume: 5503.8 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0659
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.116
• Weighted residual factors for all reflections included in the refinement: 0.1393
• Goodness-of-fit parameter for all reflections included in the refinement: 1.613
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No