Information card for entry 7206790

Structure parameters

• Formula: C25 H25 Cd N5 O11 Zn
• Calculated formula: C25 H25 Cd N5 O11 Zn
• SMILES: [Cd]123([O]4[Zn]56([O]1c1c(OC)cccc1C=[N]6c1ccccc1[N]5=Cc1cccc(OC)c14)[O]=CN(C)C)(ON(=[O]3)=O)ON(=[O]2)=O
• Title of publication: Construction of four 3d-4d/4d complexes based on salen-type schiff base ligands
• Authors of publication: Gong, Xue; Ge, Ying-Ying; Fang, Mao; Gu, Zhi-Gang; Zheng, Sheng-Run; Li, Wei-Shan; Hu, She-Jun; Li, Shu-Bin; Cai, Yue-Peng
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 23
• Pages of publication: 6911
• a: 9.9306 ± 0.0007 Å
• b: 18.8619 ± 0.0013 Å
• c: 15.0246 ± 0.001 Å
• α: 90°
• β: 97.401 ± 0.001°
• γ: 90°
• Cell volume: 2790.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0419
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0622
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No