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Information card for entry 1553117
Preview
| Coordinates | 1553117.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H21 N O3 |
|---|---|
| Calculated formula | C19 H21 N O3 |
| Title of publication | 1,3-Dipolar cycloaddition reactions of phthalic anhydrides with an azomethine ylide |
| Authors of publication | Santos, Hugo; Distiller, Amy; D'Souza, Asha M.; Arnoux, Quentin; White, Jonathan M.; Meyer, Adam G.; Ryan, John H. |
| Journal of publication | Organic Chemistry Frontiers |
| Year of publication | 2015 |
| Journal volume | 2 |
| Journal issue | 6 |
| Pages of publication | 705 |
| a | 7.2941 ± 0.0002 Å |
| b | 13.2249 ± 0.0003 Å |
| c | 17.2264 ± 0.0004 Å |
| α | 90° |
| β | 96.919 ± 0.002° |
| γ | 90° |
| Cell volume | 1649.62 ± 0.07 Å3 |
| Cell temperature | 130 ± 0.2 K |
| Ambient diffraction temperature | 130 ± 0.2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0645 |
| Residual factor for significantly intense reflections | 0.0461 |
| Weighted residual factors for significantly intense reflections | 0.1227 |
| Weighted residual factors for all reflections included in the refinement | 0.1369 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233610 (current) | 2019-11-23 | cif/ Adding structures of 1553117 via cif-deposit CGI script. |
1553117.cif |
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Users of the data should acknowledge the original authors of the
structural data.