Information card for entry 8107124

Structure parameters

• Formula: C15 H7 F8 O9 Pr
• Calculated formula: C15 H7 F8 O9 Pr
• Title of publication: Crystal structure of poly-[triaqua-(μ3-3,4,5,6-tetrafluoro-1,2-phthalato-κ4 O:O′:O′′,O′′′) (2,3,4,5-tetrafluoro-benzoato-κ2 O,O′) praseodymium(III)], C15H7F8O9Pr
• Authors of publication: Feng, Xun; Li, Rong Fang; Wang, Yang; Tian, Pan Hao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1139 - 1141
• a: 6.2167 ± 0.0003 Å
• b: 9.7769 ± 0.0005 Å
• c: 29.6562 ± 0.0015 Å
• α: 90°
• β: 93.292 ± 0.001°
• γ: 90°
• Cell volume: 1799.53 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0336
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No