Information card for entry 7121384

Structure parameters

• Chemical name: 7-methyl-1-tosylindoline
• Formula: C16 H17 N O2 S
• Calculated formula: C16 H17 N O2 S
• Title of publication: Synthesis of indolines via a palladium/norbornene-catalyzed reaction of aziridines with aryl iodides.
• Authors of publication: Liu, Ce; Liang, Yujie; Zheng, Nian; Zhang, Bo-Sheng; Feng, Yuan; Bi, Siwei; Liang, Yong-Min
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 27
• Pages of publication: 3407 - 3410
• a: 15.2125 ± 0.0008 Å
• b: 15.041 ± 0.002 Å
• c: 12.8713 ± 0.0008 Å
• α: 90°
• β: 90.483 ± 0.005°
• γ: 90°
• Cell volume: 2945 ± 0.5 ų
• Cell temperature: 290.83 ± 0.1 K
• Ambient diffraction temperature: 290.83 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1895
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1158
• Weighted residual factors for all reflections included in the refinement: 0.1784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No