Information card for entry 2013957

Structure parameters

• Chemical name: catena-Poly[europium(III)-tri-μ-2,3-dimethoxybenzoato]
• Formula: C27 H27 Eu O12
• Calculated formula: C27 H27 Eu O12
• SMILES: [Eu]1234([O]=C(O1)c1c(OC)c(OC)ccc1)(OC(=O)c1c(OC)c(OC)ccc1)(OC(=O)c1c(OC)c(OC)ccc1)[O]1[Eu]([O]=C1c1c([O]4C)c(OC)ccc1)([O]=C(O3)c1c(OC)c(OC)ccc1)OC(=[O]2)c1c(OC)c(OC)ccc1
• Title of publication: <i>catena</i>-Poly[europium(III)-tri-μ-2,3-dimethoxybenzoato]
• Authors of publication: Li, Xia; Zou, Ying-Quan; Zheng, Bo; Hu, Huai-Ming
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: m197 - m199
• a: 18.9555 ± 0.0014 Å
• b: 8.0426 ± 0.0004 Å
• c: 17.1475 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2614.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0328
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.0674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No