Information card for entry 7701349

Structure parameters

• Formula: C37 H58 N O2 Sc Si
• Calculated formula: C37 H58 N O2 Sc Si
• Title of publication: Constrained geometry scandium permethylindenyl complexes for the ring-opening polymerisation of l- and rac-lactide.
• Authors of publication: Diteepeng, Nichabhat; Buffet, Jean-Charles; Turner, Zoë R; O'Hare, Dermot
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 42
• Pages of publication: 16099 - 16107
• a: 11.8504 ± 0.0001 Å
• b: 16.914 ± 0.0002 Å
• c: 18.1946 ± 0.0002 Å
• α: 90°
• β: 103.479 ± 0.001°
• γ: 90°
• Cell volume: 3546.43 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0369
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0879
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No