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Information card for entry 1550573
Preview
| Coordinates | 1550573.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C88 H128 N8 O18 Rh2 S6 |
|---|---|
| Calculated formula | C88 H128 N8 O18 Rh2 S6 |
| Title of publication | Site-Selective Nitrenoid Insertions Utilizing Postfunctionalized Bifunctional Rhodium(II) Catalysts |
| Authors of publication | Berndt, Jan Philipp; Radchenko, Yevhenii; Becker, Jonathan; Logemann, Christian; Bhandari, Dhaka Ram; Hrdina, Radim; SCHREINER, Peter Richard |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 13.4068 ± 0.0004 Å |
| b | 14.036 ± 0.0004 Å |
| c | 14.1837 ± 0.0004 Å |
| α | 68.831 ± 0.001° |
| β | 72.514 ± 0.001° |
| γ | 69.919 ± 0.001° |
| Cell volume | 2289.69 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0505 |
| Residual factor for significantly intense reflections | 0.036 |
| Weighted residual factors for significantly intense reflections | 0.0712 |
| Weighted residual factors for all reflections included in the refinement | 0.0757 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213521 (current) | 2019-02-07 | cif/ Adding structures of 1550572, 1550573, 1550574 via cif-deposit CGI script. |
1550573.cif |
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Users of the data should acknowledge the original authors of the
structural data.