Information card for entry 7031128

Structure parameters

• Formula: C42 H60 N3 O2 Sc Si2
• Calculated formula: C42 H60 N3 O2 Sc Si2
• Title of publication: Scandium versus yttrium{amino-alkoxy-bis(phenolate)} complexes for the stereoselective ring-opening polymerization of racemic lactide and β-butyrolactone.
• Authors of publication: Chapurina, Yulia; Klitzke, Joice; Casagrande, Jr, Osvaldo de L; Awada, Mouhamad; Dorcet, Vincent; Kirillov, Evgueni; Carpentier, Jean-François
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 38
• Pages of publication: 14322 - 14333
• a: 10.4197 ± 0.0003 Å
• b: 13.9848 ± 0.0004 Å
• c: 14.841 ± 0.0003 Å
• α: 84.69 ± 0.001°
• β: 85.689 ± 0.001°
• γ: 82.797 ± 0.001°
• Cell volume: 2131.89 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0593
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No