Information card for entry 4519359

Structure parameters

• Formula: C32.25 H30.5 Cl0.5 N2 O3
• Calculated formula: C32.25 H30.5 Cl0.5 N2 O3
• Title of publication: Camphorsulfonic Acid-Mediated One-Pot Tandem Consecutive via the Ugi Four-Component Reaction for the Synthesis of Functionalized Indole and 2-Quinolone Derivatives by Switching Solvents.
• Authors of publication: Murugan, Sivan Perumal; Zhong, Hong-Jie; Wu, Chih-Yu; Pan, Hao-Wei; Chen, Chinpiao; Lee, Gene-Hsian
• Journal of publication: ACS omega
• Year of publication: 2022
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 5713 - 5729
• a: 14.8518 ± 0.0004 Å
• b: 15.7023 ± 0.0005 Å
• c: 25.8545 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6029.5 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0823
• Residual factor for significantly intense reflections: 0.0664
• Weighted residual factors for significantly intense reflections: 0.186
• Weighted residual factors for all reflections included in the refinement: 0.1995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No