Information card for entry 4084815

Structure parameters

• Formula: C22 H46 Al N O Si2
• Calculated formula: C22 H46 Al N O Si2
• SMILES: [Si](N([Si](C)(C)C)[Al]1([O]2CCCC2)C(=C(C(=C1CC)CC)CC)CC)(C)(C)C
• Title of publication: Syntheses and Structures of Stable 1-Aminoalumole Derivatives
• Authors of publication: Agou, Tomohiro; Wasano, Tatsuya; Sasamori, Takahiro; Tokitoh, Norihiro
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 23
• Pages of publication: 6963
• a: 10.6677 ± 0.0002 Å
• b: 16.6123 ± 0.0003 Å
• c: 15.1293 ± 0.0003 Å
• α: 90°
• β: 99.843 ± 0.0013°
• γ: 90°
• Cell volume: 2641.67 ± 0.09 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 6
• 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: 0.0347
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No