Information card for entry 4114238

Structure parameters

• Common name: 02054
• Formula: C7 H12.38 F3 Li O6 S
• Calculated formula: C7 H12.372 F3 Li O6 S
• Title of publication: Single-Crystal Structures of Polymer Electrolytes
• Authors of publication: Wesley A. Henderson; Neil R. Brooks; Victor G. Young
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 12098 - 12099
• a: 10.0678 ± 0.0016 Å
• b: 8.5275 ± 0.0014 Å
• c: 14.399 ± 0.002 Å
• α: 90°
• β: 96.023 ± 0.003°
• γ: 90°
• Cell volume: 1229.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0477
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0863
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No