Information card for entry 8105540

Structure parameters

• Formula: C21 H11 F8 N O12 Sm2
• Calculated formula: C21 H6 F8 N O12 Sm2
• Title of publication: Crystal structure of poly[diaqua-di-μ2-hydroxido-(μ4-3,4,5,6-tetrafluoro-1,2-phthalato-κ4 O:O′:O′′:O′′′)-(μ4-3,4,5,6-tetrafluoro-1,2-phthalato-κ5 O,O:O′:O′′:O′′′)disamarium(III)] – bipyridine (2/1), C21H11NF16O12Sm2
• Authors of publication: Feng, Xun; Wang, Rui; Wang, Xin Yi; Zhang, Ying Ying; Jia, Xi Xi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 234
• Journal issue: 1
• Pages of publication: 55 - 57
• a: 7.7872 ± 0.0005 Å
• b: 9.9149 ± 0.0006 Å
• c: 16.9804 ± 0.001 Å
• α: 79.497 ± 0.001°
• β: 76.862 ± 0.001°
• γ: 78.148 ± 0.001°
• Cell volume: 1236.8 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.1123
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No