Information card for entry 7251694

Structure parameters

• Formula: C26 H22 N2 O
• Calculated formula: C26 H22 N2 O
• Title of publication: Green and sustainable dearomative cycloaddition of arenes via visible-light energy transfer catalysis: an atom-economical synthesis of N-heterocyclic skeletons
• Authors of publication: Gore, Babasaheb Sopan; Chen, Hsing-Yin; Wang, Jeh-Jeng
• Journal of publication: Green Chemistry
• Year of publication: 2026
• Journal volume: 28
• Journal issue: 5
• Pages of publication: 2475 - 2484
• a: 10.3638 ± 0.0003 Å
• b: 11.3229 ± 0.0003 Å
• c: 16.6651 ± 0.0005 Å
• α: 90°
• β: 93.655 ± 0.003°
• γ: 90°
• Cell volume: 1951.64 ± 0.1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0551
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.1206
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No