Information card for entry 4336421

Structure parameters

• Formula: C60 H82 Br2 Mg2 N4 O4 Si4
• Calculated formula: C60 H81.4 Br2 Mg2 N4 O4 Si4
• Title of publication: Magnesium and Calcium Complexes Containing Biphenyl-Based Tridentate Iminophenolate Ligands for Ring-Opening Polymerization of rac-Lactide
• Authors of publication: Wei Yi; Haiyan Ma
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11821 - 11835
• a: 17.023 ± 0.002 Å
• b: 13.7491 ± 0.0018 Å
• c: 29.338 ± 0.004 Å
• α: 90°
• β: 101.93 ± 0.002°
• γ: 90°
• Cell volume: 6718.3 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1767
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1389
• Weighted residual factors for all reflections included in the refinement: 0.1913
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No