Information card for entry 2241088

Structure parameters

• Chemical name: {2-[(Diethylamino)methyl]indol-1-yl-κ^2^<i>N</i>,<i>N</i>'}dimethylaluminium
• Formula: C15 H23 Al N2
• Calculated formula: C15 H23 Al N2
• SMILES: [Al]1(n2c(C[N]1(CC)CC)cc1ccccc21)(C)C
• Title of publication: Synthesis, characterization and crystal structure of a 2-(diethylaminomethyl)indole ligated dimethylaluminium complex
• Authors of publication: Shephard, Logan E.; Kingsley, Nicholas B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 10
• Pages of publication: 1222 - 1225
• a: 9.7467 ± 0.0005 Å
• b: 14.1245 ± 0.0007 Å
• c: 10.9866 ± 0.0005 Å
• α: 90°
• β: 94.206 ± 0.001°
• γ: 90°
• Cell volume: 1508.42 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0248
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.0682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes