Information card for entry 4020162

Structure parameters

• Formula: C17 H30 F3 N O3 S Si
• Calculated formula: C17 H30 F3 N O3 S Si
• Authors of publication: Kathryn Hassall; Sofia Lobachevsky; Jonathan M. White
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 1993 - 1997
• a: 8.2494 ± 0.0012 Å
• b: 10.7414 ± 0.0016 Å
• c: 12.6185 ± 0.0018 Å
• α: 83.686 ± 0.002°
• β: 75.608 ± 0.002°
• γ: 70.555 ± 0.002°
• Cell volume: 1020.8 ± 0.3 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No