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Information card for entry 7129202
Preview
| Coordinates | 7129202.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H24 Ir N |
|---|---|
| Calculated formula | C19 H24 Ir N |
| Title of publication | Ir(iii)-Catalysed electrooxidative intramolecular dehydrogenative C–H/N–H coupling for the synthesis of N–H indoles |
| Authors of publication | Kim, Youyoung; Kim, Dongwook; Chang, Sukbok |
| Journal of publication | Chemical Communications |
| Year of publication | 2021 |
| a | 14.834 ± 0.003 Å |
| b | 8.096 ± 0.0016 Å |
| c | 14.131 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1697.1 ± 0.6 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0209 |
| Residual factor for significantly intense reflections | 0.0193 |
| Weighted residual factors for significantly intense reflections | 0.0492 |
| Weighted residual factors for all reflections included in the refinement | 0.0497 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.65 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270307 (current) | 2021-11-05 | cif/ Adding structures of 7129202, 7129203 via cif-deposit CGI script. |
7129202.cif |
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