Information card for entry 8105522

Structure parameters

• Formula: C52 H34 N4 O18 Sm2
• Calculated formula: C52 H34 N4 O18 Sm2
• Title of publication: Crystal structure of poly[aqua-(μ3-4-(pyridin-4-yl)isophthalato-κ4 O,O′:O′′:O′′′)-(μ2-5-carboxy-2-(pyridin-4-yl)benzoato-κ2 O:O′)samarium(III)], C26H18N2O9Sm
• Authors of publication: Song, Wei; Xu, Xue-Li; Yang, Yan-Ju; Li, Shi-Hui
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 234
• Journal issue: 1
• Pages of publication: 5 - 7
• a: 8.9665 ± 0.0003 Å
• b: 9.3617 ± 0.0003 Å
• c: 28.3925 ± 0.0009 Å
• α: 90°
• β: 95.134 ± 0.003°
• γ: 90°
• Cell volume: 2373.75 ± 0.13 ų
• Cell temperature: 287.51 ± 0.1 K
• Ambient diffraction temperature: 287.51 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0376
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.0637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No