Information card for entry 7156754

Structure parameters

• Formula: C42 H30 F N O5
• Calculated formula: C42 H30 F N O5
• Title of publication: Selective synthesis of spirooxindoles via a two-step reaction of N-phenacylpyridinium bromide, 1,3-indanedione and N-alkylisations.
• Authors of publication: Sun, Jing; Zhang, Yu; Shi, Rong-Guo; Yan, Chao-Guo
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2019
• Journal volume: 17
• Journal issue: 16
• Pages of publication: 3978 - 3983
• a: 10.252 ± 0.003 Å
• b: 11.75 ± 0.003 Å
• c: 15.681 ± 0.004 Å
• α: 99.354 ± 0.008°
• β: 103.382 ± 0.008°
• γ: 103.029 ± 0.008°
• Cell volume: 1743.8 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1367
• Residual factor for significantly intense reflections: 0.0704
• Weighted residual factors for significantly intense reflections: 0.1748
• Weighted residual factors for all reflections included in the refinement: 0.2112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No