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Information card for entry 1543438
Preview
Coordinates | 1543438.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H19 N O2 |
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Calculated formula | C19 H19 N O2 |
SMILES | C(=C)(c1ccccc1)CN1C(=O)[C@@](c2c1cccc2)(C)CO |
Title of publication | Synthesis of Quaternary 3,3-Disubstituted 2-Oxindoles from 2-Substituted Indole Using Selectfluor. |
Authors of publication | Jiang, Xiaojian; Yang, Junjie; Zhang, Feng; Yu, Pei; Yi, Peng; Sun, Yewei; Wang, Yuqiang |
Journal of publication | Organic letters |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 13 |
Pages of publication | 3154 - 3157 |
a | 5.9339 ± 0.0002 Å |
b | 12.3047 ± 0.0005 Å |
c | 21.7128 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1585.36 ± 0.11 Å3 |
Cell temperature | 199.16 ± 0.1 K |
Ambient diffraction temperature | 199.16 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0371 |
Residual factor for significantly intense reflections | 0.0337 |
Weighted residual factors for significantly intense reflections | 0.086 |
Weighted residual factors for all reflections included in the refinement | 0.0893 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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