Information card for entry 1559567

Structure parameters

• Formula: C49 H38 Cl2 Co F5 N3
• Calculated formula: C49 H38 Cl2 Co F5 N3
• SMILES: [Co]12(Cl)(Cl)[n]3c(C(=[N]1c1c(cccc1C)C)C)cccc3C(=[N]2c1c(cc(cc1F)C(c1ccc(F)cc1)c1ccc(F)cc1)C(c1ccc(F)cc1)c1ccc(F)cc1)C
• Title of publication: Fluorinated cobalt catalysts and their use in forming narrowly dispersed polyethylene waxes of high linearity and incorporating vinyl functionality
• Authors of publication: Zhang, Qiuyue; Li, Zilong; Han, Mingyang; Xiang, Junfeng; Solan, Gregory A.; Ma, Yanping; Liang, Tongling; Sun, Wen-Hua
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 2
• Pages of publication: 656 - 670
• a: 11.8773 ± 0.0006 Å
• b: 12.8721 ± 0.0005 Å
• c: 14.5308 ± 0.0006 Å
• α: 97.115 ± 0.003°
• β: 92.063 ± 0.004°
• γ: 98.641 ± 0.004°
• Cell volume: 2176.04 ± 0.17 ų
• Cell temperature: 170 ± 0.1 K
• Ambient diffraction temperature: 170 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1013
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No