Information card for entry 4130514

Structure parameters

• Formula: C20 H4 Er F24 Na O8
• Calculated formula: C20 H4 Er F24 Na O8
• SMILES: C1(C(F)(F)F)=CC(C(F)(F)F)=[O][Er]234(O1)(OC(=CC(=[O]2)C(F)(F)F)C(F)(F)F)([O]=C(C(F)(F)F)C=C(C(F)(F)F)O3)OC(=CC(=[O]4)C(F)(F)F)C(F)(F)F.[Na+]
• Title of publication: Volatile Single-Source Precursors for the Low-Temperature Preparation of Sodium-Rare Earth Metal Fluorides.
• Authors of publication: Barry, Matthew C.; Wei, Zheng; He, Tianyu; Filatov, Alexander S.; Dikarev, Evgeny V.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 28
• Pages of publication: 8883 - 8887
• a: 21.789 ± 0.002 Å
• b: 12.0958 ± 0.0011 Å
• c: 14.096 ± 0.003 Å
• α: 90°
• β: 125.614 ± 0.001°
• γ: 90°
• Cell volume: 3020.2 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.0165
• Weighted residual factors for significantly intense reflections: 0.0386
• Weighted residual factors for all reflections included in the refinement: 0.0396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No