Information card for entry 7133303

Structure parameters

• Formula: C29 H23 N2 O2 P
• Calculated formula: C29 H23 N2 O2 P
• Title of publication: Visible-light promoted radical cascade cyclization of 3-allyl-2-arylquinazolinones for the synthesis of phosphorylated dihydroisoquinolino[1,2-<i>b</i>]quinazolinones.
• Authors of publication: Huang, Jun; Ban, Caijin; Qin, Jiangping; Xu, Jiali; Gu, Yunqiong; Wei, Liang; Yuan, Jing-Mei; Huang, Guobao
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 62
• Pages of publication: 8119 - 8122
• a: 14.8254 ± 0.0006 Å
• b: 13.4214 ± 0.0005 Å
• c: 11.2282 ± 0.0005 Å
• α: 90°
• β: 93.113 ± 0.001°
• γ: 90°
• Cell volume: 2230.86 ± 0.16 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.0866
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No