Information card for entry 7055701

Structure parameters

• Formula: C41 H49 Cl2 Co N3
• Calculated formula: C40.994 H49 Cl2 Co N3
• Title of publication: Thermally stable and highly active cobalt precatalysts for vinyl-polyethylenes with narrow polydispersities: integrating fused-ring and imino-carbon protection into ligand design
• Authors of publication: Huang, Fang; Zhang, Wenjuan; Sun, Yang; Hu, Xinquan; Solan, Gregory A.; Sun, Wen-Hua
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 9
• Pages of publication: 8012
• a: 9.1533 ± 0.0018 Å
• b: 23.791 ± 0.005 Å
• c: 18.215 ± 0.004 Å
• α: 90°
• β: 97.18 ± 0.03°
• γ: 90°
• Cell volume: 3935.5 ± 1.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No