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Information card for entry 4518737
Preview
| Coordinates | 4518737.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H33 Cl3 N O2 Rh |
|---|---|
| Calculated formula | C27 H33 Cl3 N O2 Rh |
| Title of publication | Electrolytic C‒H Oxygenation via Oxidatively Induced Reductive Elimination in Rh Catalysis |
| Authors of publication | Jin, Seongho; Kim, Jinwoo; Kim, Dongwook; Park, Jung-Woo; Chang, Sukbok |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Pages of publication | 6590 - 6595 |
| a | 8.6935 ± 0.0004 Å |
| b | 11.1078 ± 0.0004 Å |
| c | 15.4392 ± 0.0006 Å |
| α | 103.343 ± 0.0013° |
| β | 102.776 ± 0.0013° |
| γ | 103.769 ± 0.0013° |
| Cell volume | 1347.51 ± 0.1 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0412 |
| Residual factor for significantly intense reflections | 0.0333 |
| Weighted residual factors for significantly intense reflections | 0.0701 |
| Weighted residual factors for all reflections included in the refinement | 0.0748 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265379 (current) | 2021-05-21 | cif/ Adding structures of 4518737 via cif-deposit CGI script. |
4518737.cif |
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