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Information card for entry 1567138
Preview
| Coordinates | 1567138.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [Ge9{Si(SiMe3)}3RhH(H)2W(Cp)2][B{C6H3(CF3)2}4]*Et2O |
|---|---|
| Formula | C73 H116 B F24 Ge9 O Rh Si12 W |
| Calculated formula | C73 H116 B F24 Ge9 O Rh Si12 W |
| Title of publication | Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 |
| Authors of publication | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 17.9023 ± 0.0005 Å |
| b | 13.8042 ± 0.0005 Å |
| c | 44.4206 ± 0.0012 Å |
| α | 90° |
| β | 96.969 ± 0.003° |
| γ | 90° |
| Cell volume | 10896.4 ± 0.6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.091 |
| Residual factor for significantly intense reflections | 0.0647 |
| Weighted residual factors for significantly intense reflections | 0.1656 |
| Weighted residual factors for all reflections included in the refinement | 0.1838 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276054 (current) | 2022-06-16 | cif/ Adding structures of 1567135, 1567136, 1567137, 1567138, 1567139 via cif-deposit CGI script. |
1567138.cif |
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Users of the data should acknowledge the original authors of the
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