Information card for entry 7019946

Structure parameters

• Formula: C29 H36 N3 O16 Tb
• Calculated formula: C29 H37 N3 O16 Tb
• SMILES: OCC.OCC.[Tb]123456([n]7c(C(=[O]1)O)cccc7C(=O)O3)([n]1c(C(=[O]2)O)cccc1C(=O)O4)[n]1c(C(=[O]5)O)cccc1C(O6)=O.OCC.OCC
• Title of publication: High efficiency co-sensitized solar cell based on luminescent lanthanide complexes with pyridine-2,6-dicarboxylic acid ligands.
• Authors of publication: Wang, Xin; Yang, Yu-Lin; Wang, Ping; Li, Liang; Fan, Rui-Qing; Cao, Wen-Wu; Yang, Bin; Wang, Hui; Liu, Jing-Yao
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 35
• Pages of publication: 10619 - 10625
• a: 16.9674 ± 0.0011 Å
• b: 10.6721 ± 0.0007 Å
• c: 18.6477 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3376.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1211
• Weighted residual factors for all reflections included in the refinement: 0.1248
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No