Information card for entry 7102409

Structure parameters

• Common name: 3,5-di-t-butylbenzo-2,6-dimesitylphenyl-1,3,2-dioxophospholane
• Chemical name: 3,5-di-t-butylbenzo-2,6-dimesitylphenyl-1,3,2-dioxophospholane
• Formula: C38 H45 O2 P
• Calculated formula: C38 O2 P
• Title of publication: Cycloaddition of phosphanylidene-sigma4-phosphoranes ArP=PMe3 and quinones to yield 1,3,2-dioxophospholanes.
• Authors of publication: Chen, Xufang; Smith, Rhett C; Protasiewicz, John D
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 2
• Pages of publication: 146 - 147
• a: 13.623 ± 0.002 Å
• b: 11.232 ± 0.0017 Å
• c: 22.372 ± 0.003 Å
• α: 90°
• β: 98.531 ± 0.012°
• γ: 90°
• Cell volume: 3385.4 ± 0.9 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.1598
• Residual factor for significantly intense reflections: 0.093
• Weighted residual factors for significantly intense reflections: 0.268
• Weighted residual factors for all reflections included in the refinement: 0.3236
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No