Information card for entry 4332340

Structure parameters

• Common name: [Eu2(4-cba)6(phen)2(H2O)2]
• Chemical name: [Eu2(4-cba)6(phen)2(H2O)2]
• Formula: C72 H44 Eu2 N10 O14
• Calculated formula: C72 H44 Eu2 N10 O14
• SMILES: c1ccc2ccc3ccc[n]4[Eu]567([n]1c2c34)(OC(=O)c1ccc(cc1)C#N)([OH2])[O]=C(O[Eu]1([n]2cccc3ccc4ccc[n]1c4c23)(OC(=O)c1ccc(cc1)C#N)([OH2])([O]=C(O5)c1ccc(cc1)C#N)(OC(=[O]7)c1ccc(cc1)C#N)[O]=C(O6)c1ccc(cc1)C#N)c1ccc(C#N)cc1
• Title of publication: Crystal Structures and Magnetic and Luminescent Properties of a Series of Homodinuclear Lanthanide Complexes with 4-Cyanobenzoic Ligand
• Authors of publication: Li, Yan; Zheng, Fa-Kun; Liu, Xi; Zou, Wen-Qiang; Guo,; Lu, Can-Zhong; Huang, Jin-Shun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6308 - 6316
• a: 8.2745 ± 0.0006 Å
• b: 12.8076 ± 0.0009 Å
• c: 16.4256 ± 0.0013 Å
• α: 97.838 ± 0.002°
• β: 102.116 ± 0.003°
• γ: 99.72 ± 0.003°
• Cell volume: 1650.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0304
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0668
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No