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Information card for entry 7120828
Preview
| Coordinates | 7120828.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H15 N O4 |
|---|---|
| Calculated formula | C17 H15 N O4 |
| Title of publication | Directed C-C Bond Cleavage of Cyclopropane Intermediate Generated from N-Tosylhydrazones and Stable Enaminones: Expedient Synthesis of Functionalized 1, 4‒Ketoaldehydes |
| Authors of publication | Ni, Meiyan; Zhang, Jianguo; Liang, Xiaoyu; Jiang, Yaojia; Loh, Teck Peng |
| Journal of publication | Chem. Commun. |
| Year of publication | 2017 |
| a | 6.3645 ± 0.0005 Å |
| b | 14.4689 ± 0.0012 Å |
| c | 15.7267 ± 0.0012 Å |
| α | 90° |
| β | 99.228 ± 0.003° |
| γ | 90° |
| Cell volume | 1429.5 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.104 |
| Residual factor for significantly intense reflections | 0.0557 |
| Weighted residual factors for significantly intense reflections | 0.1201 |
| Weighted residual factors for all reflections included in the refinement | 0.1426 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 202337 (current) | 2017-10-26 | cif/ Adding structures of 7120828 via cif-deposit CGI script. |
7120828.cif |
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Users of the data should acknowledge the original authors of the
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