Information card for entry 7133214

Structure parameters

• Common name: 9-phosphatriptycene oxide
• Chemical name: 9-phosphatriptycene oxide
• Formula: C19 H13 O P
• Calculated formula: C19 H13 O P
• Title of publication: Regulating iminophosphorane PN bond reactivity through geometric constraints with cage-shaped triarylphosphines.
• Authors of publication: Hu, Lei; Chakraborty, Sayandip; Tumanov, Nikolay; Wouters, Johan; Robiette, Raphaël; Berionni, Guillaume
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• a: 7.2774 ± 0.0002 Å
• b: 8.0944 ± 0.0003 Å
• c: 13.1388 ± 0.0004 Å
• α: 81.7506 ± 0.0009°
• β: 79.8049 ± 0.001°
• γ: 70.6319 ± 0.0009°
• Cell volume: 715.63 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No