Information card for entry 7127086

Structure parameters

• Formula: C21 H35 N O
• Calculated formula: C21 H35 N O
• Title of publication: Mg-Mg bond polarization induced by a superbulky β-diketiminate ligand.
• Authors of publication: Rösch, Bastian; Gentner, Thomas Xaver; Eyselein, Jonathan; Friedrich, Alexander; Langer, Jens; Harder, Sjoerd
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 77
• Pages of publication: 11402 - 11405
• a: 9.9088 ± 0.0003 Å
• b: 20.8368 ± 0.0011 Å
• c: 19.7657 ± 0.001 Å
• α: 90°
• β: 98.387 ± 0.004°
• γ: 90°
• Cell volume: 4037.3 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0854
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.1508
• Weighted residual factors for all reflections included in the refinement: 0.1553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No