Information card for entry 2009060

Structure parameters

• Chemical name: bis[μ-chloro-tricarbonyl(dicyclohexylphosphine)rhenium]
• Formula: C30 H46 Cl2 O6 P2 Re2
• Calculated formula: C30 H46 Cl2 O6 P2 Re2
• SMILES: C(#[O])[Re]1([PH](C2CCCCC2)C2CCCCC2)([Cl][Re](C#[O])(C#[O])(C#[O])([PH](C2CCCCC2)C2CCCCC2)[Cl]1)(C#[O])C#[O]
• Title of publication: Di-μ-chloro-bis[tricarbonyl(dicyclohexylphosphine)rhenium]
• Authors of publication: Flörke, Ulrich
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 10
• Pages of publication: IUC9900119
• a: 10.112 ± 0.002 Å
• b: 19.144 ± 0.007 Å
• c: 10.511 ± 0.003 Å
• α: 90°
• β: 118.35 ± 0.02°
• γ: 90°
• Cell volume: 1790.7 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No