Information card for entry 1515603

Structure parameters

• Formula: C8 H22 Al N3
• Calculated formula: C8 H22 Al N3
• Title of publication: Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity
• Authors of publication: Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S.
• Journal of publication: Chemical Science
• Year of publication: 2011
• Journal volume: 2
• Journal issue: 8
• Pages of publication: 1554
• a: 8.7047 ± 0.0002 Å
• b: 15.6298 ± 0.0003 Å
• c: 9.3874 ± 0.0002 Å
• α: 90°
• β: 115.922 ± 0.001°
• γ: 90°
• Cell volume: 1148.68 ± 0.04 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• 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: 0.0461
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.1002
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No