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Information card for entry 7718296
Preview
| Coordinates | 7718296.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (Briq)2IrCl2 . CH3OH |
|---|---|
| Chemical name | Bis(N-(2,6-dibromo)-4,6-di-tert-butyl-iminoxolene)dichloroiridium methanol solvate |
| Formula | C41 H50 Br4 Cl2 Ir N2 O3 |
| Calculated formula | C41 H50 Br4 Cl2 Ir N2 O3 |
| Title of publication | Bis(iminoxolene)iridium complexes over four oxidation states: from sodium-iridium bonding to ligand-centered radicals. |
| Authors of publication | Nugraha, Kahargyan; Do, Thomas H.; Brown, Seth N. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2025 |
| Journal volume | 54 |
| Journal issue | 14 |
| Pages of publication | 5896 - 5905 |
| a | 10.2904 ± 0.0014 Å |
| b | 11.1541 ± 0.0015 Å |
| c | 11.6974 ± 0.0016 Å |
| α | 65.495 ± 0.002° |
| β | 67.09 ± 0.002° |
| γ | 80.666 ± 0.002° |
| Cell volume | 1125.3 ± 0.3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 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 | 0.018 |
| Residual factor for significantly intense reflections | 0.0167 |
| Weighted residual factors for significantly intense reflections | 0.0407 |
| Weighted residual factors for all reflections included in the refinement | 0.0414 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300901 (current) | 2025-07-06 | cif/ Updating files of 7718295, 7718296, 7718297, 7718298, 7718299, 7718300, 7718301 Original log message: Adding full bibliography for 7718295--7718301.cif. |
7718296.cif |
| 298394 | 2025-03-12 | cif/ Adding structures of 7718295, 7718296, 7718297, 7718298, 7718299, 7718300, 7718301 via cif-deposit CGI script. |
7718296.cif |
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Users of the data should acknowledge the original authors of the
structural data.