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Information card for entry 1565155
Preview
| Coordinates | 1565155.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H54 Ir2 N4 S2 |
|---|---|
| Calculated formula | C46 H54 Ir2 N4 S2 |
| Title of publication | Pyrrole thioamide complexes of organo-rhodium(III), -iridium(III) and -ruthenium(II) |
| Authors of publication | Tang, Haiming; Saunders, Graham C.; Raymond, Onyekachi; Ma, Xiaochuan; Henderson, William |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2020 |
| Journal volume | 506 |
| Pages of publication | 119545 |
| a | 11.659 ± 0.0004 Å |
| b | 12.5787 ± 0.0004 Å |
| c | 14.107 ± 0.0003 Å |
| α | 90.321 ± 0.002° |
| β | 96.465 ± 0.002° |
| γ | 90.118 ± 0.003° |
| Cell volume | 2055.67 ± 0.11 Å3 |
| Cell temperature | 99.97 ± 0.11 K |
| Ambient diffraction temperature | 99.97 ± 0.11 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0527 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.0758 |
| Weighted residual factors for all reflections included in the refinement | 0.0828 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0383 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270558 (current) | 2021-11-10 | cif/ Adding structures of 1565155 via cif-deposit CGI script. |
1565155.cif |
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Users of the data should acknowledge the original authors of the
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