Information card for entry 4066958

Structure parameters

• Formula: C20 H10 Fe Mn O8 P
• Calculated formula: C20 H10 Fe Mn O8 P
• SMILES: [Fe]1([Mn]([P]1(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Synthesis, Characterization, and Reactivity of the Heterometallic Dinuclear μ-PH2and μ-PPhH Complexes FeMn(CO)8(μ-PH2) and FeMn(CO)8(μ-PPhH)‡
• Authors of publication: Colson, Adam C.; Whitmire, Kenton H.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 20
• Pages of publication: 4611
• a: 16.774 ± 0.003 Å
• b: 16.969 ± 0.003 Å
• c: 15.385 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4379.2 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1202
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0879
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No