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Information card for entry 4038334
Preview
| Coordinates | 4038334.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H17 N O2 |
|---|---|
| Calculated formula | C17 H17 N O2 |
| Title of publication | Accessing Dihydro-1,2-oxazine via Cloke-Wilson type Annulation of Cyclopropyl Carbonyls: Application towards the Diastereoselective Synthesis of Pyrrolo[1,2-b][1,2]oxazine. |
| Authors of publication | Kumar, Pankaj; Kumar, Rakesh; Banerjee, Prabal |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2020 |
| a | 62.025 ± 0.004 Å |
| b | 5.3766 ± 0.0003 Å |
| c | 8.2455 ± 0.0005 Å |
| α | 90° |
| β | 92.464 ± 0.002° |
| γ | 90° |
| Cell volume | 2747.2 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0757 |
| Residual factor for significantly intense reflections | 0.0576 |
| Weighted residual factors for significantly intense reflections | 0.1225 |
| Weighted residual factors for all reflections included in the refinement | 0.1326 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 251866 (current) | 2020-05-07 | cif/ Adding structures of 4038334 via cif-deposit CGI script. |
4038334.cif |
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Users of the data should acknowledge the original authors of the
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