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Information card for entry 1550166
Preview
| Coordinates | 1550166.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H31 Ir O2 |
|---|---|
| Calculated formula | C22 H31 Ir O2 |
| Title of publication | Mild complexation protocol for chiral CpxRh and Ir complexes suitable for in situ catalysis |
| Authors of publication | Cramer, Nicolai; Audic, Benoit; Wodrich, Matthew D. |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 10.8334 ± 0.0002 Å |
| b | 8.23239 ± 0.00014 Å |
| c | 22.2298 ± 0.0004 Å |
| α | 90° |
| β | 98.0838 ± 0.0017° |
| γ | 90° |
| Cell volume | 1962.86 ± 0.06 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | I 1 2 1 |
| Hall space group symbol | I 2y |
| Residual factor for all reflections | 0.0247 |
| Residual factor for significantly intense reflections | 0.0235 |
| Weighted residual factors for significantly intense reflections | 0.0488 |
| Weighted residual factors for all reflections included in the refinement | 0.0497 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211729 (current) | 2018-11-01 | cif/ Adding structures of 1550165, 1550166, 1550167, 1550168 via cif-deposit CGI script. |
1550166.cif |
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