Information card for entry 7718432

Structure parameters

• Formula: C54 H73.86 Al I N4
• Calculated formula: C54 H73.8578 Al I N4
• Title of publication: Divergent reduction chemistry of NHC-aluminium(III) hydrides.
• Authors of publication: Murphy, Fáinché; Kennedy, Alan R.; Weetman, Catherine E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 6038 - 6042
• a: 10.8961 ± 0.0001 Å
• b: 22.3404 ± 0.0001 Å
• c: 21.636 ± 0.0001 Å
• α: 90°
• β: 92.356 ± 0.001°
• γ: 90°
• Cell volume: 5262.25 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0688
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1861
• Weighted residual factors for all reflections included in the refinement: 0.1869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No