Information card for entry 7124220

Structure parameters

• Formula: C31 H25 N O2 S
• Calculated formula: C31 H25 N O2 S
• Title of publication: Metal-free Sulfonyl Radical-initiated Cascade Cyclization to Access Sulfonated Indolo[1,2-a]quinolines
• Authors of publication: Sun, Kai; Chen, Xiaolan; Zhang, Yinli; Li, Kai; Huang, Xian-Qiang; Peng, Yu-Yu; Qu, Lingbo; Yu, Bing
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.357 ± 0.0006 Å
• b: 8.1337 ± 0.0004 Å
• c: 14.8816 ± 0.0008 Å
• α: 90°
• β: 108.017 ± 0.002°
• γ: 90°
• Cell volume: 1192.16 ± 0.11 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1416
• Residual factor for significantly intense reflections: 0.1072
• Weighted residual factors for significantly intense reflections: 0.2598
• Weighted residual factors for all reflections included in the refinement: 0.2842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No