Information card for entry 7714568

Structure parameters

• Formula: C78 H76 D6 N2 O2 Ti2
• Calculated formula: C78 H76 D6 N2 O2 Ti2
• Title of publication: Coplanar binuclear group 4 post-metallocene complexes supported by chelating μ-(σ₂-aryl) ligands: characterisation and olefin polymerisation catalysis.
• Authors of publication: Li, Yufang; Liu, Qian; Bao, Junhui; Yiu, Shek-Man; Chan, Michael C. W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 346 - 353
• a: 10.6861 ± 0.0004 Å
• b: 16.556 ± 0.0008 Å
• c: 19.224 ± 0.0009 Å
• α: 72.239 ± 0.002°
• β: 80.612 ± 0.002°
• γ: 80.477 ± 0.002°
• Cell volume: 3171.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0373
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0968
• Weighted residual factors for all reflections included in the refinement: 0.099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No