Information card for entry 1564116

Structure parameters

• Formula: C51 H57 Br4 Cl2 Dy N6 O19 Zn2
• Calculated formula: C51 H57 Br4 Cl2 Dy N6 O19 Zn2
• SMILES: [Dy]12345678([O]9[Zn]%10%11([O]=C(O4)C)[O]3c3c(cc(Br)cc3[O]8C)C=[N]%10CCOCC[N]%11=Cc3cc(cc([O]6C)c39)Br)[O]3[Zn]46([O]2c2c(cc(Br)cc2[O]5C)C=[N]4CCOCC[N]6=Cc2c3c([O]1C)cc(Br)c2)[O]=C(O7)c1ccncc1.O=N(=O)[O-].ClCCl.OC.CO
• Title of publication: Two heteronuclear ZnII/CdII-DyIII complexes based on open-chain ether schiff base ligand: Synthesis, structures, fluorescence and antioxidation activity
• Authors of publication: Xu, Jianhua; Xia, Xinzhao; Zhang, Geng; Wu, Huilu; Qu, Yao; Xia, Lixian; Han, Xintong
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119918
• a: 30.847 ± 0.003 Å
• b: 12.3745 ± 0.0011 Å
• c: 32.761 ± 0.003 Å
• α: 90°
• β: 104.489 ± 0.002°
• γ: 90°
• Cell volume: 12107.7 ± 1.9 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 8
• 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: 0.0812
• Residual factor for significantly intense reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.1559
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No