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Information card for entry 1562389
Preview
| Coordinates | 1562389.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H32 N2 O4 S |
|---|---|
| Calculated formula | C26 H32 N2 O4 S |
| Title of publication | Catalytic (3+2) Annulation of Donor-Acceptor Aminocyclopropane Monoesters and Indoles |
| Authors of publication | Pirenne, Vincent; Robert, Emma G. L.; Waser, Jerome |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 6.3612 ± 0.00009 Å |
| b | 23.6708 ± 0.0004 Å |
| c | 15.8181 ± 0.0002 Å |
| α | 90° |
| β | 91.6343 ± 0.0014° |
| γ | 90° |
| Cell volume | 2380.84 ± 0.06 Å3 |
| Cell temperature | 140.01 ± 0.1 K |
| Ambient diffraction temperature | 140.01 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0414 |
| Residual factor for significantly intense reflections | 0.0347 |
| Weighted residual factors for significantly intense reflections | 0.088 |
| Weighted residual factors for all reflections included in the refinement | 0.0928 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265010 (current) | 2021-05-07 | cif/ Adding structures of 1562388, 1562389 via cif-deposit CGI script. |
1562389.cif |
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Users of the data should acknowledge the original authors of the
structural data.