Information card for entry 4334512

Structure parameters

• Formula: C48 H42 Eu2 N18 O15
• Calculated formula: C48 H42 Eu2 N18 O15
• SMILES: [Eu]1234567([O]8[Eu]9%10%11%12([n]%13c(C8(N[N]2=C(c2[n]1cccc2)c1ncccc1)c1[n]%11cccc1)cccc%13)([O]3C(N[N]5=C(c1[n]4cccc1)c1ncccc1)(c1[n]%12cccc1)c1[n]%10cccc1)(ON(=[O]9)=O)[OH2])(ON(=[O]6)=O)ON(=[O]7)=O.N(=O)(=O)[O-].N#CC.N#CC
• Title of publication: Dinuclear Lanthanide(III) Complexes by Metal-Ion-Assisted Hydration of Di-2-pyridyl Ketone Azine
• Authors of publication: Nikolaos C. Anastasiadis; Carlos M. Granadeiro; Nikolaos Klouras; Luís Cunha-Silva; Catherine P. Raptopoulou; Vassilis Psycharis; Vlasoula Bekiari; Salete S. Balula; Albert Escuer; Spyros P. Perlepes
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 4145 - 4147
• a: 12.239 ± 0.0002 Å
• b: 17.4002 ± 0.0003 Å
• c: 24.9997 ± 0.0005 Å
• α: 90°
• β: 94.405 ± 0.001°
• γ: 90°
• Cell volume: 5308.24 ± 0.16 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0914
• Residual factor for significantly intense reflections: 0.0734
• Weighted residual factors for significantly intense reflections: 0.1285
• Weighted residual factors for all reflections included in the refinement: 0.142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No