Information card for entry 4065129

Structure parameters

• Formula: C63 H73 Co
• Calculated formula: C62.43 H72.31 Co1.034
• Title of publication: Cobalt Complexes Containing Dimethyldihydropyrene-Substituted Cyclobutadiene Ligands
• Authors of publication: Zhang, Pengrong; Brkic, Zinka; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen G.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 20
• Pages of publication: 5396
• a: 11.6975 ± 0.0006 Å
• b: 13.7749 ± 0.0006 Å
• c: 16.2886 ± 0.0008 Å
• α: 87.532 ± 0.002°
• β: 76.013 ± 0.003°
• γ: 80.364 ± 0.002°
• Cell volume: 2510.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1058
• Residual factor for significantly intense reflections: 0.076
• Weighted residual factors for significantly intense reflections: 0.1922
• Weighted residual factors for all reflections included in the refinement: 0.2115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No