Information card for entry 7133713

Structure parameters

• Formula: C27 H37 O5 P
• Calculated formula: C27 H37 O5 P
• Title of publication: Photoinduced [4+2] cycloaddition of dienes and quinonemethides.
• Authors of publication: Jose, Jobsy; Yadav, Arun; Tripathi, Chandra Bhushan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 80
• Pages of publication: 11315 - 11318
• a: 16.3807 ± 0.0002 Å
• b: 16.9986 ± 0.0003 Å
• c: 9.8142 ± 0.0001 Å
• α: 90°
• β: 101.166 ± 0.001°
• γ: 90°
• Cell volume: 2681.02 ± 0.06 ų
• Cell temperature: 295.15 K
• Ambient diffraction temperature: 295.15 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: 0.0654
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1654
• Weighted residual factors for all reflections included in the refinement: 0.1721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No