Information card for entry 7017794

Structure parameters

• Formula: C52 H76 Mg N10 O2
• Calculated formula: C52 H76 Mg N10 O2
• SMILES: [Mg]1234(Oc5c(cc(cc5C[N]1(CC[N]2(C)C)C)C(C)(C)CC(C)(C)C)n1nc2ccccc2n1)Oc1c(cc(cc1C[N]3(C)CC[N]4(C)C)C(C)(C)CC(C)(C)C)n1nc2ccccc2n1
• 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: 23.2246 ± 0.0016 Å
• b: 8.3575 ± 0.0005 Å
• c: 27.7372 ± 0.0016 Å
• α: 90°
• β: 105.4 ± 0.004°
• γ: 90°
• Cell volume: 5190.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1399
• Residual factor for significantly intense reflections: 0.1005
• Weighted residual factors for significantly intense reflections: 0.2106
• Weighted residual factors for all reflections included in the refinement: 0.2269
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No