Information card for entry 7046397

Structure parameters

• Formula: C108 H167 N3 O16 Ti3
• Calculated formula: C108 H167 N3 O16 Ti3
• Title of publication: Aggregated initiators: defining their role in the ROP of rac-lactide.
• Authors of publication: Cols, Jean-Marie E P; Hill, Victoria G.; Williams, Stella K.; McIntosh, Ruaraidh D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10626 - 10635
• a: 14.242 ± 0.0006 Å
• b: 30.8848 ± 0.0014 Å
• c: 32.6649 ± 0.0013 Å
• α: 90°
• β: 92.799 ± 0.002°
• γ: 90°
• Cell volume: 14350.9 ± 1.1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• 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: 0.1003
• Residual factor for significantly intense reflections: 0.0695
• Weighted residual factors for significantly intense reflections: 0.1704
• Weighted residual factors for all reflections included in the refinement: 0.1872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No