Information card for entry 2210140

Structure parameters

• Formula: C10 H12 Cl La O8
• Calculated formula: C10 H12 Cl La O8
• SMILES: [La]123456([OH2])([OH2])(Cl)[O]=C7C[O]8c9c(cccc9)[O]9CC(O[La]89%10([O]17)([OH2])([OH2])(Cl)[O]=C(C[O]2c1c(cccc1)[O]4CC(=O)O5)[O]3%10)=[O][La]12345([OH2])([OH2])(Cl)[O]=C7C[O]8c9c(cccc9)[O]9CC(=[O]6)O[La]689([O]17)([OH2])([OH2])(Cl)[O]=C(C[O]2c1c(cccc1)[O]3CC(=O)O4)[O]65
• Title of publication: Poly[diaquachloro(μ~3~-<i>p</i>-phenylenedioxydiacetato)lanthanum(III)]
• Authors of publication: Xiao-Feng Li; Zheng-Bo Han
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2024 - m2025
• a: 13.8892 ± 0.0011 Å
• b: 6.2703 ± 0.0005 Å
• c: 14.98 ± 0.0011 Å
• α: 90°
• β: 95.151 ± 0.001°
• γ: 90°
• Cell volume: 1299.33 ± 0.17 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.025
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0538
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes