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Information card for entry 1568858
Preview
| Coordinates | 1568858.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C104 H96 Cl2 D6 O3 P4 Rh2 |
|---|---|
| Calculated formula | C104 H96 Cl2 D6 O3 P4 Rh2 |
| Title of publication | Controlling selectivity for dechlorination of poly(vinyl chloride) with (xantphos)RhCl. |
| Authors of publication | Bush, Nancy G.; Assefa, Mikiyas K.; Bac, Selin; Mallikarjun Sharada, Shaama; Fieser, Megan E. |
| Journal of publication | Materials horizons |
| Year of publication | 2023 |
| Journal volume | 10 |
| Journal issue | 6 |
| Pages of publication | 2047 - 2052 |
| a | 11.4014 ± 0.0005 Å |
| b | 16.6771 ± 0.0007 Å |
| c | 22.4823 ± 0.0009 Å |
| α | 99.153 ± 0.002° |
| β | 96.453 ± 0.002° |
| γ | 91.012 ± 0.002° |
| Cell volume | 4190.9 ± 0.3 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 | 0.0294 |
| Residual factor for significantly intense reflections | 0.0276 |
| Weighted residual factors for significantly intense reflections | 0.0697 |
| Weighted residual factors for all reflections included in the refinement | 0.0711 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284982 (current) | 2023-07-05 | cif/ Updating files of 1568858 Original log message: Adding full bibliography for 1568858.cif. |
1568858.cif |
| 282611 | 2023-04-12 | cif/ Adding structures of 1568858 via cif-deposit CGI script. |
1568858.cif |
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Users of the data should acknowledge the original authors of the
structural data.