Information card for entry 7232950

Structure parameters

• Formula: C22 H21 N3 O4 S2
• Calculated formula: C22 H21 N3 O4 S2
• Title of publication: Electrochemically enabled chemoselective sulfonylation and hydrazination of indoles
• Authors of publication: Zhang, Yu-Zhen; Mo, Zu-Yu; Wang, Heng-Shan; Wen, Xiao-An; Tang, Hai-Tao; Pan, Ying-Ming
• Journal of publication: Green Chemistry
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 14
• Pages of publication: 3807
• a: 12.0153 ± 0.001 Å
• b: 12.5845 ± 0.001 Å
• c: 15.2028 ± 0.0009 Å
• α: 77.758 ± 0.006°
• β: 85.3 ± 0.006°
• γ: 72.021 ± 0.007°
• Cell volume: 2136.5 ± 0.3 ų
• Cell temperature: 293.75 ± 0.1 K
• Ambient diffraction temperature: 293.75 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.087
• Residual factor for significantly intense reflections: 0.074
• Weighted residual factors for significantly intense reflections: 0.1433
• Weighted residual factors for all reflections included in the refinement: 0.1891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No