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Information card for entry 7707517
Preview
| Coordinates | 7707517.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H63 Ir N2 O4 S |
|---|---|
| Calculated formula | C58 H63 Ir N2 O4 S |
| Title of publication | Synthesis, structure and reactivity of iridium complexes containing a bis-cyclometalated tridentate C^N^C ligand. |
| Authors of publication | Cheung, Wai-Man; Chong, Man-Chun; Sung, Herman H.-Y.; Cheng, Shun-Cheung; Williams, Ian D.; Ko, Chi-Chiu; Leung, Wa-Hung |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 24 |
| Pages of publication | 8512 - 8523 |
| a | 10.3452 ± 0.0004 Å |
| b | 15.7451 ± 0.0006 Å |
| c | 16.1341 ± 0.0006 Å |
| α | 94.912 ± 0.003° |
| β | 99.262 ± 0.003° |
| γ | 105.162 ± 0.003° |
| Cell volume | 2480.87 ± 0.17 Å3 |
| Cell temperature | 173 ± 0.1 K |
| Ambient diffraction temperature | 173 ± 0.1 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 | 0.028 |
| Residual factor for significantly intense reflections | 0.0257 |
| Weighted residual factors for significantly intense reflections | 0.062 |
| Weighted residual factors for all reflections included in the refinement | 0.0638 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267145 (current) | 2021-07-05 | cif/ Updating files of 7707513, 7707514, 7707515, 7707516, 7707517, 7707518, 7707519, 7707520 Original log message: Adding full bibliography for 7707513--7707520.cif. |
7707517.cif |
| 265570 | 2021-05-28 | cif/ Adding structures of 7707513, 7707514, 7707515, 7707516, 7707517, 7707518, 7707519, 7707520 via cif-deposit CGI script. |
7707517.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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Users of the data should acknowledge the original authors of the
structural data.