Information card for entry 2241432

Structure parameters

• Chemical name: Poly[(μ~3~-formato)(μ~4~-oxalato)terbium(III)]
• Formula: C3 H O6 Tb
• Calculated formula: C3 H O6 Tb
• SMILES: [Tb+3].C(=O)([O-])C(=O)[O-].C(=O)[O-]
• Title of publication: Crystal structure of a mixed-ligand terbium(III) coordination polymer containing oxalate and formate ligands, having a three-dimensional fcu topology
• Authors of publication: Kittipong, Chainok; Khemthong, Phailyn; Kielar, Filip; Zhou, Yan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 1
• Pages of publication: 87 - 91
• a: 7.0138 ± 0.0003 Å
• b: 10.6077 ± 0.0004 Å
• c: 6.6021 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 491.2 ± 0.03 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0147
• Residual factor for significantly intense reflections: 0.0119
• Weighted residual factors for significantly intense reflections: 0.0241
• Weighted residual factors for all reflections included in the refinement: 0.0247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes