Information card for entry 4501466

Structure parameters

• Formula: C21 H25 Cl2 N3 Ni O2
• Calculated formula: C21 H25 Cl2 N3 Ni O2
• Title of publication: Synthesis, Characterization, and Ethylene Polymerization Behavior of 8-(Nitroarylamino)-5,6,7-trihydroquinolylnickel Dichlorides: Influence of the Nitro Group and Impurities on Catalytic Activity
• Authors of publication: Zhang, Liping; Hao, Xiang; Sun, Wen-Hua; Redshaw, Carl
• Journal of publication: ACS Catalysis
• Year of publication: 2011
• Journal volume: 1
• Journal issue: 10
• Pages of publication: 1213
• a: 9.1206 ± 0.0018 Å
• b: 28.489 ± 0.006 Å
• c: 9.4194 ± 0.0019 Å
• α: 90°
• β: 116.45 ± 0.03°
• γ: 90°
• Cell volume: 2191.3 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No