Information card for entry 4110974

Structure parameters

• Formula: C27 H63 Mg2 N3 O Si6
• Calculated formula: C27 H63 Mg2 N3 O Si6
• Title of publication: Kinetics and Mechanism of Ketone Enolization Mediated by Magnesium Bis(hexamethyldisilazide)
• Authors of publication: Xuyang He; J. Jacob Morris; Bruce C. Noll; Seth N. Brown; Kenneth W. Henderson
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 13599 - 13610
• a: 9.0548 ± 0.0005 Å
• b: 14.5893 ± 0.0007 Å
• c: 15.6973 ± 0.0008 Å
• α: 84.429 ± 0.002°
• β: 83.604 ± 0.002°
• γ: 79.376 ± 0.002°
• Cell volume: 2019.2 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No