Information card for entry 1577083

Structure parameters

• Formula: C62 H94 Li2 N4 O
• Calculated formula: C62 H94 Li2 N4 O
• Title of publication: Aluminylation: a generalizable route towards low-valent aluminum under moderate conditions with controlled product nuclearity through precursor design
• Authors of publication: Reuel, Paris C.; Shandilya, Yogesh; Wattoo, M. Talha; Altman, Alison B.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 10.8117 ± 0.0006 Å
• b: 14.0773 ± 0.0008 Å
• c: 19.9743 ± 0.0011 Å
• α: 74.173 ± 0.003°
• β: 86.035 ± 0.003°
• γ: 86.57 ± 0.004°
• Cell volume: 2915.2 ± 0.3 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1368
• Residual factor for significantly intense reflections: 0.0938
• Weighted residual factors for significantly intense reflections: 0.2276
• Weighted residual factors for all reflections included in the refinement: 0.2717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No