Information card for entry 8106222

Structure parameters

• Formula: C6 H5 O8 Y
• Calculated formula: C6 H5 O8 Y
• Title of publication: Crystal structure of poly[tetraaqua-(μ4-oxalato-κ4 O,O′:O′′,O′′′)-(μ8-benzene-1,2,4,5-tetracarboxylato-κ8 O 1:O 2:O 3:O 4:O 5:O 6:O 7:O 8)yttrium(III)], C6H5O8Y
• Authors of publication: Wen, Zhi-Hui; Zhao, Xiao-Xi; Zhao, Dan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 4
• Pages of publication: 583 - 584
• a: 6.209 ± 0.0017 Å
• b: 8.573 ± 0.004 Å
• c: 8.863 ± 0.002 Å
• α: 111.018 ± 0.006°
• β: 109.85 ± 0.004°
• γ: 91.866 ± 0.006°
• Cell volume: 407.8 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1155
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No