Information card for entry 7103276

Structure parameters

• Formula: C18 H48 Al2 N10
• Calculated formula: C17.5 H46.5 Al2 N9.75
• Title of publication: Atom efficient cyclotrimerization of dimethylcyanamide catalyzed by aluminium amide: a combined experimental and theoretical investigation.
• Authors of publication: Dornan, Peter; Rowley, Christopher N; Priem, Jessica; Barry, Seán T; Burchell, Tara J; Woo, Tom K; Richeson, Darrin S
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 31
• Pages of publication: 3645 - 3647
• a: 8.6281 ± 0.0011 Å
• b: 10.3468 ± 0.0013 Å
• c: 16.497 ± 0.002 Å
• α: 82.882 ± 0.002°
• β: 80.646 ± 0.002°
• γ: 70.938 ± 0.002°
• Cell volume: 1369.5 ± 0.3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0988
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1491
• Weighted residual factors for all reflections included in the refinement: 0.1702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No