Information card for entry 1563000

Structure parameters

• Formula: C52 H68 La2 N16 O51 W6
• Calculated formula: C52 H68 La2 N16 O51 W6
• SMILES: C1(c2cc(N(=O)=O)cc(c2)N(=O)=O)=[O][La]23([O]=CN(C)C)([O]=CN(C)C)([O]=CN(C)C)(OC(c4cc(N(=O)=O)cc(N(=O)=O)c4)=[O][La]([O]=C(c4cc(N(=O)=O)cc(c4)N(=O)=O)O3)([O]=CN(C)C)([O]=CN(C)C)(O1)([O]=CN(C)C)(OC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=[O]2)[O]=CN(C)C)[O]=CN(C)C.[O]12345[W]678(O[W]9%102(O[W]24(O6)(O[W]43(O[W]5(O7)(O[W]1(O8)(=O)(O9)O4)(=O)O2)(O%10)=O)=O)=O)=O
• Title of publication: Lanthanide-organic complexes based on polyoxometalates: Solvent effect on the luminescence properties
• Authors of publication: Tang, Qun; Liu, Shu-Xia; Liang, Da-Dong; Ma, Feng-Ji; Ren, Guo-Jian; Wei, Feng; Yang, Yuan; Li, Cong-Cong
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 190
• Pages of publication: 85 - 91
• a: 13.3315 ± 0.0014 Å
• b: 13.8926 ± 0.0012 Å
• c: 14.2678 ± 0.0012 Å
• α: 102.322 ± 0.007°
• β: 100.982 ± 0.008°
• γ: 116.338 ± 0.01°
• Cell volume: 2187.5 ± 0.5 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: 0.0569
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0388
• Weighted residual factors for all reflections included in the refinement: 0.0398
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No