Information card for entry 7102381

Structure parameters

• Formula: C37 H69 Al Li N O4
• Calculated formula: C37 H69 Al Li N O4
• Title of publication: Isolation and structural elucidation of a key aluminoaromatic intermediate and evidence for dismutation phenomena in TMP-alumination chemistry.
• Authors of publication: Conway, Ben; Hevia, Eva; García-Alvarez, Joaquín; Graham, David V; Kennedy, Alan R; Mulvey, Robert E
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 48
• Pages of publication: 5241 - 5243
• a: 9.888 ± 0.0006 Å
• b: 10.5709 ± 0.0008 Å
• c: 10.8837 ± 0.0008 Å
• α: 108.652 ± 0.003°
• β: 107.329 ± 0.004°
• γ: 99.374 ± 0.004°
• Cell volume: 986.15 ± 0.12 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0913
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No