Information card for entry 7246608

Structure parameters

• Formula: C19 H19 N O3 S Se
• Calculated formula: C19 H19 N O3 S Se
• Title of publication: Versatile electrooxidative amino- and oxyselenation of alkenes
• Authors of publication: Wang, Renjie; Zhang, Nana; Zhang, Yonghong; Wang, Bin; Xia, Yu; Sun, Kai; Jin, Weiwei; Li, Xinyong; Liu, Chenjiang
• Journal of publication: Green Chemistry
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 10
• Pages of publication: 3925 - 3930
• a: 14.852 ± 0.003 Å
• b: 8.3709 ± 0.0017 Å
• c: 15.745 ± 0.003 Å
• α: 90°
• β: 111.498 ± 0.004°
• γ: 90°
• Cell volume: 1821.3 ± 0.6 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• 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: 0.0802
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0967
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No