Information card for entry 4067830

Structure parameters

• Formula: C19 H24 Al Cl3 N2
• Calculated formula: C19 H24 Al Cl3 N2
• SMILES: Cl[Al](Cl)(Cl)[NH]=C(c1ccccc1)Nc1c(cccc1C(C)C)C(C)C
• Title of publication: Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles
• Authors of publication: Maheswari, K.; Reddy, N. Dastagiri
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 197
• a: 8.203 ± 0.0004 Å
• b: 9.3135 ± 0.0004 Å
• c: 13.9156 ± 0.0006 Å
• α: 85.993 ± 0.004°
• β: 88.458 ± 0.004°
• γ: 89.708 ± 0.004°
• Cell volume: 1060.14 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0619
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0789
• Weighted residual factors for all reflections included in the refinement: 0.0852
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No