Information card for entry 7242912

Structure parameters

• Formula: C21 H29 Cl2 N5 Zn
• Calculated formula: C21 H29 Cl2 N5 Zn
• SMILES: [Zn]1(Cl)([n]2c(cc(n2CN(Cn2[n]1c(cc2C)C)c1ccc(cc1)C(C)C)C)C)Cl
• Title of publication: Synthesis, structures, and catalytic efficiency in ring opening polymerization of rac-lactide with tridentate vs. bidentate cobalt(ii), zinc(ii), and cadmium(ii) complexes containing N-substituted N,N-bis((3,5-dimethyl-1H-pyrazol-1-yl)methyl)amine ligands
• Authors of publication: Choe, Solhye; Lee, Hyosun; Nayab, Saira
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 31
• Pages of publication: 18840 - 18851
• a: 12.837 ± 0.003 Å
• b: 12.585 ± 0.003 Å
• c: 14.222 ± 0.003 Å
• α: 90°
• β: 92.04 ± 0.03°
• γ: 90°
• Cell volume: 2296.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.042
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.1085
• Weighted residual factors for all reflections included in the refinement: 0.1105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.61 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No