Information card for entry 7133216

Structure parameters

• Common name: (N-phenyl-9-phosphatriptycene-iminium)-2,3,5,6-tetrafluorophenyl]- bis(2,3,4,5,6-pentafluorophenyl)-fluoroborate dichloromethane solvate
• Chemical name: (N-phenyl-9-phosphatriptycene-iminium)-2,3,5,6-tetrafluorophenyl]- bis(2,3,4,5,6-pentafluorophenyl)-fluoroborate dichloromethane solvate
• Formula: C44 H20 B Cl2 F15 N P
• Calculated formula: C44 H20 B Cl2 F15 N 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
• Journal volume: 60
• Journal issue: 55
• Pages of publication: 7073 - 7076
• a: 11.2365 ± 0.0002 Å
• b: 12.2624 ± 0.0002 Å
• c: 14.8185 ± 0.0003 Å
• α: 83.39 ± 0.001°
• β: 78.06 ± 0.001°
• γ: 74.601 ± 0.001°
• Cell volume: 1921.98 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0378
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No