Information card for entry 7125324

Structure parameters

• Chemical name: 5-azoniaspiro[4.4]nonane 10-phenyl-9-phosphatriptycene-10-borate selenide
• Formula: C32 H33 B N P Se
• Calculated formula: C32 H33 B N P Se
• Title of publication: Fusing triphenylphosphine with tetraphenylborate: introducing the 9-phosphatriptycene-10-phenylborate (PTB) anion.
• Authors of publication: Drover, Marcus W.; Nagata, Koichi; Peters, Jonas C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 57
• Pages of publication: 7916 - 7919
• a: 17.601 ± 0.003 Å
• b: 17.365 ± 0.002 Å
• c: 17.358 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5305.3 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.1133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No