Information card for entry 7049346

Structure parameters

• Formula: C29 H36 Co N2
• Calculated formula: C29 H36 Co N2
• Title of publication: Cyclometallation reactions of a three-coordinate cobalt(i) complex bearing a nonsymmetric N-heterocyclic carbene ligand.
• Authors of publication: Gao, Yafei; Chen, Qi; Leng, Xuebing; Deng, Liang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 26
• Pages of publication: 9676 - 9683
• a: 20.7929 ± 0.0017 Å
• b: 10.5688 ± 0.0008 Å
• c: 22.0184 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4838.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1142
• Residual factor for significantly intense reflections: 0.0964
• Weighted residual factors for significantly intense reflections: 0.1663
• Weighted residual factors for all reflections included in the refinement: 0.1748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.192
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No