Information card for entry 4134889

Structure parameters

• Formula: C35 H67 Al K N O8 Si2
• Calculated formula: C35 H67 Al K N O8 Si2
• Title of publication: Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion.
• Authors of publication: Koshino, Kota; Kinjo, Rei
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 11.3793 ± 0.0006 Å
• b: 13.5186 ± 0.0005 Å
• c: 27.8039 ± 0.0014 Å
• α: 90°
• β: 98.587 ± 0.002°
• γ: 90°
• Cell volume: 4229.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.1381
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No