Information card for entry 7128579

Structure parameters

• Common name: Morpholine Addukt
• Chemical name: Morpholine Addukt
• Formula: C34 H60 Al N O3
• Calculated formula: C34 H60 Al N O3
• Title of publication: Synthesis of novel six-, seven- and eight-membered aluminum-containing rings by alumole ring expansion.
• Authors of publication: Drescher, Regina; Ritschel, Benedikt; Dewhurst, Rian D.; Deißenberger, Andrea; Hofmann, Alexander; Braunschweig, Holger
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 61
• Pages of publication: 7505 - 7508
• a: 20.5142 ± 0.0011 Å
• b: 11.6374 ± 0.0005 Å
• c: 14.3998 ± 0.0007 Å
• α: 90°
• β: 93.907 ± 0.002°
• γ: 90°
• Cell volume: 3429.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0769
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1451
• Weighted residual factors for all reflections included in the refinement: 0.1539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No