Information card for entry 7058354

Structure parameters

• Formula: C29 H31 Cl N2 O9
• Calculated formula: C29 H31 Cl N2 O9
• Title of publication: [3+2] cycloaddition reaction for synthesis of spiro[indoline-3,3'-pyrrolidines] and evaluation of cytotoxicity to cancer cells
• Authors of publication: Huang, Ying; Huang, Yi-Xin; Sun, Jing; Yan, Chaoguo
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 23
• Pages of publication: 8903 - 8910
• a: 11.0078 ± 0.0016 Å
• b: 25.498 ± 0.004 Å
• c: 11.128 ± 0.0014 Å
• α: 90°
• β: 109.121 ± 0.004°
• γ: 90°
• Cell volume: 2951.1 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1677
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No