Information card for entry 7017795

Structure parameters

• Formula: C28 H43 N5 O Zn
• Calculated formula: C28 H43 N5 O Zn
• SMILES: [Zn]12(Oc3c(n4nc5ccccc5n4)cc(cc3C[N]1(C)CC[N]2(C)C)C(C)(C)CC(C)(C)C)CC
• Title of publication: Zinc and magnesium complexes incorporated by bis(amine) benzotriazole phenoxide ligand: synthesis, characterization, photoluminescent properties and catalysis for ring-opening polymerization of lactide.
• Authors of publication: Sung, Chang-Yu; Li, Chen-Yu; Su, Jing-Kai; Chen, Ting-Yi; Lin, Chia-Her; Ko, Bao-Tsan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 3
• Pages of publication: 953 - 961
• a: 11.4457 ± 0.0002 Å
• b: 18.0495 ± 0.0003 Å
• c: 13.8545 ± 0.0002 Å
• α: 90°
• β: 104.912 ± 0.001°
• γ: 90°
• Cell volume: 2765.8 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0551
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.1376
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No