Information card for entry 7033661

Structure parameters

• Formula: C32 H48 Al Li N8
• Calculated formula: C32 H48 Al Li N8
• SMILES: c12c3N[Al]4(Nc1cccc2ccc3)Nc1c2c(ccc1)cccc2N4.[Li]12([N](C)(C)CC[N]1(C)C)[N](C)(C)CC[N]2(C)C
• Title of publication: Multiple deprotonation of primary aromatic diamines by LiAlH4.
• Authors of publication: Less, Robert J.; Allen, Lucy K.; Steiner, Alexander; Wright, Dominic S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 9
• Pages of publication: 4141 - 4147
• a: 21.4696 ± 0.0013 Å
• b: 21.4696 ± 0.0013 Å
• c: 29.3995 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13551.5 ± 1.4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.1388
• Residual factor for significantly intense reflections: 0.1034
• Weighted residual factors for significantly intense reflections: 0.2653
• Weighted residual factors for all reflections included in the refinement: 0.2892
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No