Information card for entry 4312885

Structure parameters

• Formula: C20 H19 N8 O9 Tb
• Calculated formula: C22 H19 N8 O9 Tb
• SMILES: [Tb]123456(ON(=[O]1)=O)(ON(=[O]2)=O)(ON(=[O]3)=O)[n]1c(C[N]6(Cc2cccc[n]42)Cc2cccc[n]52)[nH]c2c1cccc2
• Title of publication: Syntheses, Crystal Structures, and Luminescent Properties of Lanthanide Complexes with Tripodal Ligands Bearing Benzimidazole and Pyridine Groups
• Authors of publication: Xiao-Ping Yang; Bei-Sheng Kang; Wai-Kwok Wong; Cheng-Yong Su; Han-Qin Liu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 169 - 179
• a: 17.275 ± 0.005 Å
• b: 17.275 ± 0.005 Å
• c: 17.275 ± 0.005 Å
• α: 99.268 ± 0.004°
• β: 99.268 ± 0.004°
• γ: 99.268 ± 0.004°
• Cell volume: 4928 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :R
• Hall space group symbol: -P 3*
• Residual factor for all reflections: 0.208
• Residual factor for significantly intense reflections: 0.0726
• Weighted residual factors for significantly intense reflections: 0.1809
• Weighted residual factors for all reflections included in the refinement: 0.2713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No