Information card for entry 7056192

Structure parameters

• Formula: C81 H124 N4 O6 Zr
• Calculated formula: C81 H124 N4 O6 Zr
• Title of publication: Immortal Ring-Opening Polymerization of Lactides with Super High Monomer to Catalyst Ratios Initiated by Zirconium and Titanium Complexes Containing Multidentate Amino-bis(phenolate) Ligands
• Authors of publication: Wang, Baolong; Zhao, Huanqin; Wang, Liying; Sun, Junmin; Zhang, Yongfeng; Cao, Zhenzhu
• Journal of publication: New J. Chem.
• Year of publication: 2017
• a: 11.867 ± 0.0006 Å
• b: 16.2871 ± 0.0009 Å
• c: 24.4789 ± 0.0014 Å
• α: 105.498 ± 0.002°
• β: 90.376 ± 0.002°
• γ: 102.18 ± 0.002°
• Cell volume: 4446.6 ± 0.4 ų
• Cell temperature: 282 ± 2 K
• Ambient diffraction temperature: 282 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1367
• Weighted residual factors for all reflections included in the refinement: 0.1426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No