Information card for entry 7123138

Structure parameters

• Chemical name: dibenzo[b,e]phosphindolizine-P-oxide
• Formula: C16 H11 O P
• Calculated formula: C16 H11 O P
• Title of publication: Dibenzo[b,e]phosphindolizines Synthesized by Ring-Closing Metathesis of Benzo[b]phospholes with Two Vinyl Tethers
• Authors of publication: Tsurusaki, Akihiro; Matsumoto, Hiroyo; Kamikawa, Ken
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 11.341 ± 0.004 Å
• b: 9.571 ± 0.003 Å
• c: 11.845 ± 0.004 Å
• α: 90°
• β: 112.2 ± 0.005°
• γ: 90°
• Cell volume: 1190.4 ± 0.7 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 4
• 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: 0.0432
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No