Information card for entry 7122345

Structure parameters

• Formula: C32 H25 N O2
• Calculated formula: C32 H25 N O2
• Title of publication: Merging base-promoted C-C bond cleavage and iron-catalyzed skeletal rearrangement involving C-C/C-H bond activation: synthesis of highly functionalized carbazoles.
• Authors of publication: Kong, Lingkai; Wang, Mengdan; Wang, Ye; Song, Bo; Yang, Yajie; Yao, Qiyi; Li, Yanzhong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 78
• Pages of publication: 11009 - 11012
• a: 13.1322 ± 0.0004 Å
• b: 18.0792 ± 0.0005 Å
• c: 11.7504 ± 0.0003 Å
• α: 90°
• β: 102.654 ± 0.001°
• γ: 90°
• Cell volume: 2722.01 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0668
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1729
• Weighted residual factors for all reflections included in the refinement: 0.1802
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No