Information card for entry 2010707

Structure parameters

• Formula: C70 H22 Al B2 Cl F40 Li2 N2
• Calculated formula: C70 H22 Al B2 Cl F40 Li2 N2
• SMILES: [Al]1(C)(Cl)N(C=CC=[N]1c1ccccc1)c1ccccc1.[B-](c1c(c(F)c(c(c1F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(F)c(c(c(c1F)F)F)F)c1c(c(c(c(c1F)F)F)F)F.c1(c(c(c(c(c1F)F)F)F)F)[B-](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F.[Li+].[Li+].c1ccccc1
• Title of publication: Halocarbon and arene coordination of lithium(I) in (1-anilino-3-phenyliminopropenyl)chloro(methyl)aluminium bis{[tetrakis(pentafluorophenyl)borato]lithium} benzene solvate
• Authors of publication: Guzei, Ilia A.; Radzewich, Catherine E.; Jordan, Richard F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 279 - 281
• a: 12.2522 ± 0.0009 Å
• b: 13.8727 ± 0.001 Å
• c: 22.2931 ± 0.0016 Å
• α: 79.743 ± 0.001°
• β: 80.829 ± 0.001°
• γ: 64.077 ± 0.001°
• Cell volume: 3339.2 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No