Information card for entry 7058761

Structure parameters

• Formula: C22 H32 Br2 Cl N3 Ni O2
• Calculated formula: C22 H30 Br2 Cl N3 Ni O
• Title of publication: Lewis acids in situ modulate pyridazine-imine Ni catalysed ethylene (co)polymerisation
• Authors of publication: Wang, Guohong; Li, Min; Pang, Wenmin; Chen, Min; Tan, Chen
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 34
• Pages of publication: 13630
• a: 23.206 ± 0.005 Å
• b: 23.206 ± 0.005 Å
• c: 8.801 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4105 ± 3 ų
• Cell temperature: 273 K
• Ambient diffraction temperature: 273 K
• Number of distinct elements: 7
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.0978
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.1115
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No