Information card for entry 7235456

Structure parameters

• Formula: C70 H96 N2 O8 Zr2
• Calculated formula: C70 H96 N2 O8 Zr2
• Title of publication: Ring-opening polymerization of cyclic esters initiated by zirconium, titanium and yttrium complexes
• Authors of publication: Tsai, Chen-Yen; Du, Hong-Cyuan; Chang, Jen-Chieh; Huang, Bor-Hunn; Ko, Bao-Tsan; Lin, Chu-Chieh
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 28
• Pages of publication: 14527
• a: 13.3903 ± 0.0005 Å
• b: 15.7017 ± 0.0006 Å
• c: 19.7441 ± 0.0007 Å
• α: 69.349 ± 0.003°
• β: 89.497 ± 0.003°
• γ: 65.072 ± 0.004°
• Cell volume: 3474.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0531
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No