Information card for entry 1519361

Structure parameters

• Common name: 1
• Chemical name: complex 1
• Formula: C64 H88 N2 O5 Sc
• Calculated formula: C64 H88 N2 O5 Sc
• Title of publication: Synthesis and characterization of rare-earth metal complexes supported by a new pentadentate Schiff base and their application in heteroselective polymerization of rac-lactide
• Authors of publication: Cui, Yu; Gu, Weikai; Wang, Yaorong; Zhao, Bei; Yao, Yingming; Shen, Qi
• Journal of publication: Catal. Sci. Technol.
• Year of publication: 2015
• Journal volume: 5
• Journal issue: 6
• Pages of publication: 3302
• a: 12.8779 ± 0.0009 Å
• b: 19.9196 ± 0.0014 Å
• c: 24.2784 ± 0.0019 Å
• α: 90°
• β: 103.146 ± 0.007°
• γ: 90°
• Cell volume: 6064.7 ± 0.8 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 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: 0.1107
• Residual factor for significantly intense reflections: 0.0696
• Weighted residual factors for significantly intense reflections: 0.1795
• Weighted residual factors for all reflections included in the refinement: 0.2074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No