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Information card for entry 1550574
Preview
| Coordinates | 1550574.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C88 H100 F24 N8 O16 Rh2 S4 |
|---|---|
| Calculated formula | C88.0008 H100.002 F24 N8 O16.0004 Rh2 S4.0004 |
| 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 | 14.0242 ± 0.0009 Å |
| b | 14.3859 ± 0.0009 Å |
| c | 17.8002 ± 0.0011 Å |
| α | 89.158 ± 0.002° |
| β | 89.755 ± 0.002° |
| γ | 62.152 ± 0.002° |
| Cell volume | 3174.9 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0409 |
| Residual factor for significantly intense reflections | 0.0342 |
| Weighted residual factors for significantly intense reflections | 0.0799 |
| Weighted residual factors for all reflections included in the refinement | 0.0829 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| 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. |
1550574.cif |
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Users of the data should acknowledge the original authors of the
structural data.