Information card for entry 4305899

Structure parameters

• Formula: C114 H110 Dy2 N22 O37
• Calculated formula: C114 H110 Dy2 N22 O37
• SMILES: C1(COc2c(C(NCc3ncccc3)=[O][Dy]345(ON(=[O]3)=O)([O]=N(=O)O4)([O]=N(=O)O5)([OH2])[O]=C(NCc3ncccc3)c3c(OCC(COc4c(C(NCc5ncccc5)=[O][Dy]567([O]=C(NCc8ncccc8)c8c(OC1)cccc8)(ON(=[O]5)=O)([O]=N(O6)=O)([O]=N(=O)O7)[OH2])cccc4)(COc1c(C(=O)NCc4ncccc4)cccc1)COc1c(C(=O)NCc4ncccc4)cccc1)cccc3)cccc2)(COc1c(C(=O)NCc2ncccc2)cccc1)COc1c(C(=O)NCc2ncccc2)cccc1.O
• Title of publication: Synthesis, Structures, and Luminescence Properties of Lanthanide Complexes with Structurally Related New Tetrapodal Ligands Featuring Salicylamide Pendant Arms
• Authors of publication: Xueqin Song; Xiaoyan Zhou; Weisheng Liu; Wei Dou; Jingxin Ma; Xiaoliang Tang; Jiangrong Zheng
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11501 - 11513
• a: 31.122 ± 0.007 Å
• b: 16.464 ± 0.004 Å
• c: 26.762 ± 0.006 Å
• α: 90°
• β: 114.814 ± 0.003°
• γ: 90°
• Cell volume: 12447 ± 5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1544
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1524
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No