Information card for entry 7128144

Structure parameters

• Formula: C20 H15 F4 O P
• Calculated formula: C20 H15 F4 O P
• Title of publication: All-carbon phosphoranes <i>via</i> difluorocarbene trapping.
• Authors of publication: Smirnov, Vladimir O.; Volodin, Alexander D.; Korlyukov, Alexander A.; Dilman, Alexander D.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 39
• Pages of publication: 4823 - 4826
• a: 15.0201 ± 0.0006 Å
• b: 9.3245 ± 0.0004 Å
• c: 25.3352 ± 0.0011 Å
• α: 90°
• β: 104.918 ± 0.001°
• γ: 90°
• Cell volume: 3428.7 ± 0.3 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.095
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No