Information card for entry 4078894

Structure parameters

• Formula: C25 H30 Co4 Si
• Calculated formula: C25 H30 Co4 Si
• SMILES: [CH]123[C]45([Co]6789%101([cH]1[cH]9[cH]8[cH]7[cH]61)[Co]167892([cH]2[cH]8[cH]7[cH]6[cH]12)[Co]12674%10([cH]4[cH]7[cH]6[cH]2[cH]14)[Co]1246359[cH]3[cH]6[cH]4[cH]2[cH]13)[Si](C)(C)C
• Title of publication: Formation and Reactivity of a Co4-μ-Alkyne Cluster from a Co(I)-Alkene Complex
• Authors of publication: Weding, Nico; Spannenberg, Anke; Jackstell, Ralf; Hapke, Marko
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 15
• Pages of publication: 5660
• a: 9.8205 ± 0.0002 Å
• b: 16.7399 ± 0.0004 Å
• c: 14.5673 ± 0.0004 Å
• α: 90°
• β: 106.695 ± 0.002°
• γ: 90°
• Cell volume: 2293.83 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• 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: 0.035
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0563
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No