Information card for entry 7161056

Structure parameters

• Chemical name: 11-Benzyl-3-(4-chlorophenyl)-5,6-dihydroindolizino[8,7-b]indole
• Formula: C27 H21 Cl N2
• Calculated formula: C27 H21 Cl N2
• Title of publication: Base-Promoted Intermolecular Cyclization of Substituted 3-Aryl-3-chloropropenals with Tetrahydro-β-carboline: A Method for the Synthesis of Indolizino[8,7-b]indole Compounds
• Authors of publication: Chen, Kai rong; Yang, Miao; Chen, Shuang; Gong, Yanchuan; Xu, Junnan; Ye, Mei xiang; Zhang, Jie; Guo, Liang
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2025
• a: 13.844 ± 0.0006 Å
• b: 11.6532 ± 0.0005 Å
• c: 12.5453 ± 0.0006 Å
• α: 90°
• β: 99.307 ± 0.003°
• γ: 90°
• Cell volume: 1997.25 ± 0.16 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 298 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: 0.0634
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1299
• Weighted residual factors for all reflections included in the refinement: 0.1381
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No