Information card for entry 7025556

Structure parameters

• Formula: C82 H94 Eu2 N8 O28 S2
• Calculated formula: C82 H94 Eu2 N8 O28 S2
• SMILES: [Eu]235678([O]=C9O[Eu]%10%11%12%13([O]=C(O5)c4c(OCC(NS(=O)(=O)c5ccc(C)cc5)(COc5ccccc5C(=[O]8)[O]7%11)COc5ccccc5C(=[O]%10)O%13)cccc4)([O]6C(=[O]%12)c4ccccc4OCC(COc4ccccc94)(NS(=O)(=O)c4ccc(C)cc4)COc4ccccc4C(=[O]2)O3)([O]=CN(C)C)[O]=CN(C)C)([O]=CN(C)C)[O]=CN(C)C.C(=O)N(C)C.N(C=O)(C)C
• Title of publication: Synthesis, radii dependent self-assembly crystal structures and luminescent properties of rare earth (III) complexes with a tripodal salicylic derivative.
• Authors of publication: Wang, Ya-Wen; Zhang, Yan-Ling; Dou, Wei; Zhang, Ai-Jiang; Qin, Wen-Wu; Liu, Wei-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 38
• Pages of publication: 9013 - 9021
• a: 12.638 ± 0.002 Å
• b: 13.316 ± 0.002 Å
• c: 15.053 ± 0.003 Å
• α: 82.07 ± 0.01°
• β: 66.8 ± 0.01°
• γ: 72.55 ± 0.01°
• Cell volume: 2220.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0329
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0629
• Weighted residual factors for all reflections included in the refinement: 0.0644
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No