Information card for entry 4344712

Structure parameters

• Formula: C16 Al Cl12 F24 Li O4
• Calculated formula: C16 Al Cl12 F24 Li O4
• SMILES: [Al]12([O](C(C3(Cl)Cl)(C(F)(F)F)C(F)(F)F)[Li]45([Cl]3)([O]2[C@](C([Cl]5)(Cl)Cl)(C([F]4)(F)F)C(F)(F)F)[F]C(F)(F)[C@@](O1)(C(Cl)(Cl)Cl)C(F)(F)F)OC(C(Cl)(Cl)Cl)(C(F)(F)F)C(F)(F)F
• Title of publication: An Aliphatic Solvent-Soluble Lithium Salt of the Perhalogenated Weakly Coordinating Anion [Al(OC(CCl3)(CF3)2)4](.).
• Authors of publication: Zheng, Xin; Zhang, Zaichao; Tan, Gengwen; Wang, Xinping
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 1008 - 1010
• a: 10.709 ± 0.003 Å
• b: 13.59 ± 0.003 Å
• c: 11.786 ± 0.003 Å
• α: 90°
• β: 92.665 ± 0.003°
• γ: 90°
• Cell volume: 1713.4 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0764
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.1998
• Weighted residual factors for all reflections included in the refinement: 0.2294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No