Information card for entry 7156581

Structure parameters

• Formula: C H Cl N
• Calculated formula: C3.09677 H2.45161 Cl0.129032 N0.258065
• Title of publication: B(C₆F₅)₃-catalyzed Markovnikov addition of indoles to aryl alkynes: an approach toward bis(indolyl)alkanes.
• Authors of publication: Ling, Fei; Xiao, Lian; Fang, Lu; Feng, Cong; Xie, Zhen; Lv, Yaping; Zhong, Weihui
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 47
• Pages of publication: 9274 - 9278
• a: 10.4828 ± 0.0005 Å
• b: 13.6099 ± 0.0006 Å
• c: 13.9679 ± 0.0005 Å
• α: 76.703 ± 0.004°
• β: 79.086 ± 0.004°
• γ: 80.64 ± 0.004°
• Cell volume: 1889.45 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0868
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.1329
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No