Information card for entry 4060027

Structure parameters

• Formula: C24.5 H18 Br2 Co F8 N3 O0.5
• Calculated formula: C24.5 H18 Br2 Co F8 N3 O0.5
• Title of publication: Selective Dimerization/Oligomerization of α-Olefins by Cobalt Bis(imino)pyridine Catalysts Stabilized by Trifluoromethyl Substituents: Group 9 Metal Catalysts with Productivities Matching Those of Iron Systems
• Authors of publication: Kilian P. Tellmann; Vernon C. Gibson; Andrew J. P. White; David J. Williams
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Pages of publication: 280 - 286
• a: 15.1794 ± 0.0012 Å
• b: 11.3447 ± 0.0006 Å
• c: 15.9514 ± 0.0012 Å
• α: 90°
• β: 98.358 ± 0.007°
• γ: 90°
• Cell volume: 2717.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0665
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1041
• Weighted residual factors for all reflections included in the refinement: 0.1117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No