Information card for entry 7217281

Structure parameters

• Common name: Li(thf)4-Aletbat
• Formula: C77 H122 Al Cl2 Li O8
• Calculated formula: C77 H122 Al Cl2 Li O8
• Title of publication: Halogen-free water-stable aluminates as replacement for persistent fluorinated weakly-coordinating anions
• Authors of publication: Söhner, T.; Braun, F.; Over, L. C.; Mehlhose, S.; Rominger, F.; Straub, B. F.
• Journal of publication: Green Chem.
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 11
• Pages of publication: 4696
• a: 16.4252 ± 0.001 Å
• b: 16.4896 ± 0.001 Å
• c: 29.6929 ± 0.0018 Å
• α: 90°
• β: 102.666 ± 0.001°
• γ: 90°
• Cell volume: 7846.5 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1094
• Residual factor for significantly intense reflections: 0.0789
• Weighted residual factors for significantly intense reflections: 0.2113
• Weighted residual factors for all reflections included in the refinement: 0.2375
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No