Information card for entry 7135788

Structure parameters

• Formula: C25 H27 N O3
• Calculated formula: C25 H27 N O3
• Title of publication: Iodine-photoredox dual catalysis unlocks bifunctional reactivity of α-diazoesters in radical cascade cyclization reactions <i>via</i> remote C-I bond dissociation.
• Authors of publication: Wang, Xu-Yang; Wang, Can; Ma, Yong-Min; Zhao, Peng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 41
• Pages of publication: 10515 - 10519
• a: 10.3209 ± 0.0002 Å
• b: 11.6795 ± 0.0002 Å
• c: 17.3932 ± 0.0003 Å
• α: 90°
• β: 97.822 ± 0.001°
• γ: 90°
• Cell volume: 2077.12 ± 0.06 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1438
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No