Information card for entry 7120799

Structure parameters

• Formula: C22 H26 Cs Eu N6 Na2 O18
• Calculated formula: C22 H15 Cs Eu N6 Na2 O18
• SMILES: [Cs+].C1(=O)O[Eu]23456([n]7c(C(=O)O2)cc(N)cc7C(=O)O5)([n]2c(C(=O)O3)cc(cc2C(=O)O4)N)OC(=O)c2cc(cc1[n]62)N.[Na+].OC.O.O.O.[Na+].O.O
• Title of publication: Selective cytotoxicity and luminescence imaging of cancer cells with a dipicolinato-based EuIII complex
• Authors of publication: Monteiro, J. H. S. K.; Machado, D.; de Hollanda, L. M.; Lancellotti, M.; Sigoli, F. A.; de Bettencourt-Dias, A.
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 9.5125 ± 0.0002 Å
• b: 24.0522 ± 0.0006 Å
• c: 14.1809 ± 0.0003 Å
• α: 90°
• β: 104.649 ± 0.0015°
• γ: 90°
• Cell volume: 3139.07 ± 0.12 ų
• Cell temperature: 101 ± 2 K
• Ambient diffraction temperature: 101 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.14
• Residual factor for significantly intense reflections: 0.0709
• Weighted residual factors for significantly intense reflections: 0.1501
• Weighted residual factors for all reflections included in the refinement: 0.1793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No