Information card for entry 7113192

Structure parameters

• Formula: C96 H146 Al3 Li3 N6 O3
• Calculated formula: C96.012 H146.028 Al3 Li3 N6 O3
• Title of publication: Base free lithium-organoaluminate and the gallium congener: potential precursors to heterometallic assemblies
• Authors of publication: Singh, Sanjay; Chai, Jianfang; Pal, Aritra; Jancik, Vojtech; Roesky, Herbert W.; Herbst-Irmer, Regine
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2007
• Journal issue: 46
• Pages of publication: 4934 - 4936
• a: 15.847 ± 0.002 Å
• b: 15.847 ± 0.002 Å
• c: 21.396 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4653.3 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0258
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0661
• Weighted residual factors for all reflections included in the refinement: 0.0667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Duplicate of: 7102310
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No