Information card for entry 7056665

Structure parameters

• Formula: C64 H56 Eu Na O10
• Calculated formula: C64 H56 Eu Na O10
• SMILES: C1(=[O][Eu]2345(OC(=C1)c1ccccc1)([O]1=C(C=C([O]2[Na]1([OH]CC)[O]4C(=CC(=[O]5)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)OC(=CC(=[O]3)c1ccccc1)c1ccccc1)c1ccccc1.C(C)O
• Title of publication: An efficient route for design of luminescent composite materials based on polyethylene containing europium dibenzoylmethanate
• Authors of publication: Roitershtein, Dmitrii M.; Puntus, Lada N.; Lyssenko, Konstantin A.; Taidakov, Ilya V.; Varaksina, Evgenia; Minyaev, Mikhail M.; Gerasin, Viktor Anatol'evich; Guseva, Maria A.; Vinogradov, Alexey V.; Savchenko, Maria S.; Nifant'ev, Ilya E.
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 22
• Pages of publication: 13663 - 13672
• a: 25.835 ± 0.002 Å
• b: 8.3357 ± 0.0008 Å
• c: 25.37 ± 0.002 Å
• α: 90°
• β: 90.106 ± 0.0019°
• γ: 90°
• Cell volume: 5463.5 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0502
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No