Information card for entry 4030371

Structure parameters

• Formula: C24 H16 N2 O6
• Calculated formula: C24 H16 N2 O6
• SMILES: c1(ccccc1)C(CON1C(=O)c2ccccc2C1=O)ON1C(=O)c2ccccc2C1=O
• Title of publication: Metal-Free Three-Component Oxyazidation of Alkenes with Trimethylsilyl Azide and N-Hydroxyphthalimide.
• Authors of publication: Xia, Xiao-Feng; Gu, Zhen; Liu, Wentao; Wang, Haijun; Xia, Yongmei; Gao, Haiyan; Liu, Xiang; Liang, Yong-Min
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 80
• Journal issue: 1
• Pages of publication: 290
• a: 8.0113 ± 0.0003 Å
• b: 34.7315 ± 0.0011 Å
• c: 8.13 ± 0.0003 Å
• α: 90°
• β: 114.014 ± 0.002°
• γ: 90°
• Cell volume: 2066.33 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.061
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1191
• Weighted residual factors for all reflections included in the refinement: 0.1369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No