Information card for entry 1552830

Structure parameters

• Formula: C53.5 H61 Mg N3 O2 Si2
• Calculated formula: C53.5 H61 Mg N3 O2 Si2
• Title of publication: Highly Active Chiral Oxazolinyl Aminophenolate Magnesium Initiators for Isoselective Ring-Opening Polymerization of rac-Lactide: Dinuclearity Induced Enantiomorphic Site Control
• Authors of publication: Hu, Jianwen; Kan, Chao; Wang, Haobing; Ma, Haiyan
• Journal of publication: Macromolecules
• Year of publication: 2018
• Journal volume: 51
• Journal issue: 14
• Pages of publication: 5304
• a: 22.162 ± 0.003 Å
• b: 11.233 ± 0.0013 Å
• c: 19.873 ± 0.003 Å
• α: 90°
• β: 98.551 ± 0.005°
• γ: 90°
• Cell volume: 4892.3 ± 1.1 ų
• Cell temperature: 130 K
• Ambient diffraction temperature: 130 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1342
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.0805
• Weighted residual factors for all reflections included in the refinement: 0.1039
• Goodness-of-fit parameter for all reflections included in the refinement: 0.941
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No