Information card for entry 4077605

Structure parameters

• Formula: C21 H9 Al2 F15
• Calculated formula: C21 H9 Al2 F15
• SMILES: [Al]1([CH3][Al]([CH3]1)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)(C)c1c(c(c(c(c1F)F)F)F)F
• Title of publication: Ligand Exchange and Alkyl Abstraction Involving (Perfluoroaryl)boranes and -alanes with Aluminum and Gallium Alkyls
• Authors of publication: Klosin, Jerzy; Roof, Gordon R.; Chen, Eugene Y.-X.; Abboud, Khalil A.
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 23
• Pages of publication: 4684
• a: 9.119 ± 0.001 Å
• b: 9.919 ± 0.001 Å
• c: 13.029 ± 0.002 Å
• α: 95.601 ± 0.002°
• β: 98.379 ± 0.002°
• γ: 101.148 ± 0.002°
• Cell volume: 1134.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0704
• Weighted residual factors for all reflections included in the refinement: 0.0733
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No