Information card for entry 4000331

Structure parameters

• Common name: 01293y
• Formula: C9 H18 F3 Li O7 S
• Calculated formula: C9 H18 F3 Li O7 S
• Journal of publication: Chemistry of Materials
• Year of publication: 2003
• a: 13.017 ± 0.002 Å
• b: 6.3311 ± 0.0009 Å
• c: 18.692 ± 0.003 Å
• α: 90°
• β: 97.281 ± 0.002°
• γ: 90°
• Cell volume: 1528 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1412
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No