Information card for entry 7043465

Structure parameters

• Formula: C32 H34 N2 O2 Zn2
• Calculated formula: C32 H34 N2 O2 Zn2
• SMILES: c1[n]2c(ccc1)C(=C(c1ccccc1)[O]1[Zn]2([O]2C(=C(C)c3cccc[n]3[Zn]12CC)c1ccccc1)CC)C
• Title of publication: β-Pyridylenolate zinc catalysts for the ring-opening homo- and copolymerization of ε-caprolactone and lactides
• Authors of publication: Bai, Jianliang; Xiao, Xia; Zhang, Yue; Chao, Jianbin; Chen, Xia
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 8.6781 ± 0.0017 Å
• b: 8.5619 ± 0.0017 Å
• c: 18.781 ± 0.004 Å
• α: 90°
• β: 91.38 ± 0.03°
• γ: 90°
• Cell volume: 1395 ± 0.5 ų
• Cell temperature: 273 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• 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: 0.0436
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.1288
• Weighted residual factors for all reflections included in the refinement: 0.1382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No