Information card for entry 4078426

Structure parameters

• Formula: C59 H70 N2 O4 Zn2
• Calculated formula: C59 H70 N2 O4 Zn2
• SMILES: [Zn]12([O]3[Zn]([n]4c(cccc4C)CC3(c3ccccc3)c3ccccc3)([O]2C(Cc2[n]1c(ccc2)C)(c1ccccc1)c1ccccc1)CC)CC.O1CCCC1.O1CCCC1.Cc1ccccc1
• Title of publication: Magnesium and Zinc Complexes Supported byN,O-Bidentate Pyridyl Functionalized Alkoxy Ligands: Synthesis and Immortal ROP of ε-CL andl-LA
• Authors of publication: Wang, Yang; Zhao, Wei; Liu, Dongtao; Li, Shihui; Liu, Xinli; Cui, Dongmei; Chen, Xuesi
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 11
• Pages of publication: 4182
• a: 10.8501 ± 0.0005 Å
• b: 11.5735 ± 0.0005 Å
• c: 11.8514 ± 0.0005 Å
• α: 118.604 ± 0.001°
• β: 92.056 ± 0.001°
• γ: 97.707 ± 0.001°
• Cell volume: 1286.19 ± 0.1 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0804
• Weighted residual factors for all reflections included in the refinement: 0.0835
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No