Information card for entry 4518022

Structure parameters

• Formula: C80.5 H85.6 B F24 K Ni O8 P2
• Calculated formula: C80.5 H85.6 B F24 K Ni O8 P2
• Title of publication: Elucidating Secondary Metal Cation Effects on Nickel Olefin Polymerization Catalysts
• Authors of publication: Tran, Thi V.; Karas, Lucas J.; Wu, Judy I.; Do, Loi H.
• Journal of publication: ACS Catalysis
• Year of publication: 2020
• Pages of publication: 10760
• a: 13.151 ± 0.003 Å
• b: 13.356 ± 0.003 Å
• c: 24.585 ± 0.006 Å
• α: 86.239 ± 0.002°
• β: 81.17 ± 0.003°
• γ: 87.895 ± 0.003°
• Cell volume: 4256.3 ± 1.7 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1246
• Residual factor for significantly intense reflections: 0.0926
• Weighted residual factors for significantly intense reflections: 0.2612
• Weighted residual factors for all reflections included in the refinement: 0.2941
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No