Information card for entry 7105368

Structure parameters

• Formula: C14 H29 Al N2
• Calculated formula: C14 H29 Al N2
• SMILES: C1(N(C=CN1C(C)(C)C)C(C)(C)C)=[Al](C)(C)C
• Title of publication: Unusual reactivity in organoaluminium and NHC chemistry: deprotonation of AlMe(3) by an NHC moiety involving the formation of a sterically bulky NHC-AlMe(3) Lewis adduct.
• Authors of publication: Schmitt, Anne-Laure; Schnee, Gilles; Welter, Richard; Dagorne, Samuel
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 2480 - 2482
• a: 9.4995 ± 0.0006 Å
• b: 15.066 ± 0.001 Å
• c: 11.288 ± 0.0005 Å
• α: 90°
• β: 95.311 ± 0.003°
• γ: 90°
• Cell volume: 1608.6 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1398
• 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