Information card for entry 4067079

Structure parameters

• Common name: DIP cobalt(I) 4-methylphenyl complex
• Chemical name: (2.6-di-{1-(2,6-dimethylphenyl)ethyliminyl}pyriidine cobalt(I) 4-methylphenyl complex
• Formula: C32 H34 Co N3
• Calculated formula: C32 H34 Co N3
• SMILES: [Co]12([n]3c(C(=[N]1c1c(cccc1C)C)C)cccc3C(=[N]2c1c(cccc1C)C)C)c1ccc(cc1)C
• Title of publication: Binuclear Oxidative Addition of Aryl Halides
• Authors of publication: Zhu, Di; Budzelaar, Peter H. M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 22
• Pages of publication: 5759
• a: 8.3015 ± 0.0004 Å
• b: 10.6604 ± 0.0006 Å
• c: 15.9805 ± 0.0009 Å
• α: 91.7982 ± 0.001°
• β: 93.3207 ± 0.0014°
• γ: 103.782 ± 0.0014°
• Cell volume: 1369.72 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1342
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No