Information card for entry 2006877

Structure parameters

• Chemical name: octacarbonyl-μ-chloro-μ-dicyclohexylphosphido-dimanganese
• Formula: C20 H22 Cl Mn2 O8 P
• Calculated formula: C20 H22 Cl Mn2 O8 P
• SMILES: C(#[O])[Mn]1(C#[O])(C#[O])(C#[O])[P](C2CCCCC2)(C2CCCCC2)[Mn](C#[O])(C#[O])(C#[O])(C#[O])[Cl]1
• Title of publication: Octacarbonyl-μ-chloro-μ-dicyclohexylphosphido-dimanganese
• Authors of publication: Flörke, Ulrich; Haupt, Hans-Jürgen
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 12
• Pages of publication: 1799 - 1801
• a: 17.659 ± 0.003 Å
• b: 8.477 ± 0.002 Å
• c: 17.763 ± 0.003 Å
• α: 90°
• β: 114.1 ± 0.01°
• γ: 90°
• Cell volume: 2427.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for all reflections: 0.122
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections: 1.028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No