Information card for entry 7025455

Structure parameters

• Formula: C52 H36 Eu2 N2 O18
• Calculated formula: C52 H36 Eu2 N2 O18
• SMILES: C1=[O][Eu]2345([O]6c7c1cccc7C=[O][Eu]1786([O]=Cc6cccc(c6[O]31)C=[O]4)([O]=Cc1cccc(c1O8)C=O)[O]=Cc1cccc(c1O7)C=O)([O]=Cc1c(O2)c(C=O)ccc1)[O]=Cc1cccc(c1O5)C=O.N#CC.N#CC
• Title of publication: Fluorescent dialdehyde ligand for the encapsulation of dinuclear luminescent lanthanide complexes.
• Authors of publication: Lin, Po-Heng; Leclère, Mathieu; Long, Jérôme; Burchell, Tara J.; Korobkov, Ilia; Clérac, Rodolphe; Murugesu, Muralee
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 24
• Pages of publication: 5698 - 5704
• a: 8.625 ± 0.002 Å
• b: 12.069 ± 0.003 Å
• c: 12.6 ± 0.003 Å
• α: 102.731 ± 0.003°
• β: 103.459 ± 0.003°
• γ: 101.456 ± 0.003°
• Cell volume: 1200.3 ± 0.5 ų
• Cell temperature: 202 ± 2 K
• Ambient diffraction temperature: 202 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No