Information card for entry 4314115

Structure parameters

• Common name: [HB(3,5-(CF3)2Pz)3]AlMe2
• Formula: C17 H10 Al B F18 N6
• Calculated formula: C17 H10 Al B F18 N6
• SMILES: [Al]1([n]2n(c(cc2C(F)(F)F)C(F)(F)F)[BH](n2[n]1c(cc2C(F)(F)F)C(F)(F)F)n1nc(cc1C(F)(F)F)C(F)(F)F)(C)C
• Title of publication: Syntheses of Aluminum and Zinc Alkyl Complexes of a Highly Fluorinated Tris(pyrazolyl)borate Using [HB(3,5-(CF3)2Pz)3]Ag(THF) as the Ligand Transfer Agent
• Authors of publication: H. V. Rasika Dias; Wiechang Jin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5034 - 5036
• a: 9.284 ± 0.002 Å
• b: 11.788 ± 0.002 Å
• c: 12.604 ± 0.001 Å
• α: 76.055 ± 0.01°
• β: 69.3 ± 0.012°
• γ: 85.176 ± 0.013°
• Cell volume: 1252.3 ± 0.4 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0642
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for all reflections: 0.1123
• Weighted residual factors for significantly intense reflections: 0.1002
• Goodness-of-fit parameter for all reflections: 1.047
• Goodness-of-fit parameter for significantly intense reflections: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No