Information card for entry 7220490

Structure parameters

• Formula: C134 H114 B2 Br2 Co2 F48 N6 O2
• Calculated formula: C134 H114 B2 Br2 Co2 F48 N6 O2
• Title of publication: The behaviour of β-triketimine cobalt complexes in the polymerization of isoprene
• Authors of publication: Mair, F. S.; Alnajrani, Mohammed Nasser
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 12.5422 ± 0.0008 Å
• b: 16.3657 ± 0.001 Å
• c: 17.6818 ± 0.001 Å
• α: 73.037 ± 0.005°
• β: 87.555 ± 0.005°
• γ: 76.085 ± 0.006°
• Cell volume: 3368.1 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0706
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.147
• Weighted residual factors for all reflections included in the refinement: 0.1559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No