Information card for entry 7123754

Structure parameters

• Chemical name: P2PCoCOSitBuPh2
• Formula: C44.53 H56.84 Co O P3 Si
• Calculated formula: C44.5231 H56.838 Co O P3 Si
• Title of publication: O-Functionalization of a Cobalt Carbonyl Generates a Terminal Cobalt Carbyne
• Authors of publication: Deegan, Meaghan M.; Peters, Jonas C.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.4158 ± 0.0011 Å
• b: 16.6407 ± 0.0012 Å
• c: 12.8005 ± 0.0011 Å
• α: 90°
• β: 95.289 ± 0.004°
• γ: 90°
• Cell volume: 2209.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.95 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0804
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No