Information card for entry 7160514

Structure parameters

• Formula: C25 H28 N2 O2
• Calculated formula: C25 H28 N2 O2
• Title of publication: Pd-catalyzed efficient synthesis of 3-formylindole derivatives with diaziridinone.
• Authors of publication: Wang, Jianjun; Yang, E.; Liu, Wei; Zhang, Shiwei; Shi, Yian
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 20
• Pages of publication: 5006 - 5015
• a: 9.734 Å
• b: 10.474 ± 0.004 Å
• c: 11.936 ± 0.004 Å
• α: 78.427 ± 0.005°
• β: 66.163 ± 0.009°
• γ: 81.294 ± 0.009°
• Cell volume: 1087.1 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2168
• Residual factor for significantly intense reflections: 0.1043
• Weighted residual factors for significantly intense reflections: 0.2641
• Weighted residual factors for all reflections included in the refinement: 0.3097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No