Information card for entry 2311998

Structure parameters

• Chemical name: <i>catena</i>-Poly[tris{μ~2~-3-carboxy-2,3-bis[(4-methylphenyl)carbonyloxy]propanoato}tris(methanol)europium(III)]
• Formula: C63 H63 Eu O27
• Calculated formula: C63 H63 Eu O27
• SMILES: [Eu]12(OC(=O)[C@@H](OC(=O)c3ccc(cc3)C)[C@H](OC(=O)c3ccc(cc3)C)C(=O)O)([OH]C)(OC(=O)[C@@H](OC(=O)c3ccc(cc3)C)[C@H](OC(=O)c3ccc(cc3)C)C(=O)O)([OH]C)(OC(=O)[C@@H](OC(=O)c3ccc(cc3)C)[C@H](OC(=O)c3ccc(cc3)C)C(=O)O)([OH]C)O[C@@H](O)[C@@H](OC(=O)c3ccc(cc3)C)[C@H](OC(=O)c3ccc(cc3)C)C(=O)O[Eu]([OH]C)(OC(=O)[C@@H](OC(=O)c3ccc(cc3)C)[C@H](OC(=O)c3ccc(cc3)C)[C@@H](O1)O)([OH]C)(OC(=O)[C@@H](OC(=O)c1ccc(cc1)C)[C@H](OC(=O)c1ccc(cc1)C)[C@@H](O2)O)[OH]C
• Title of publication: Luminescent and magnetic bifunctional coordination complex based on a chiral tartaric acid derivative and europium.
• Authors of publication: Han, Mei Rong; Li, Shao Dong; Ma, Ling; Yao, Bang; Feng, Si Si; Zhu, Miao Li
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2019
• Journal volume: 75
• Journal issue: Pt 9
• Pages of publication: 1220 - 1227
• a: 27.194 ± 0.003 Å
• b: 27.194 ± 0.003 Å
• c: 7.6221 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4881.5 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections included in the refinement: 0.0746
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No