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Information card for entry 7701682
Preview
| Coordinates | 7701682.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H56 B Ir N2 O2 S2 |
|---|---|
| Calculated formula | C59 H56 B Ir N2 O2 S2 |
| Title of publication | Room temperature phosphorescent triarylborane functionalized iridium complexes. |
| Authors of publication | Kumar, George Rajendra; Behera, Santosh Kumar; Thilagar, Pakkirisamy |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 20 |
| Pages of publication | 6817 - 6823 |
| a | 36.34 ± 0.005 Å |
| b | 13.93 ± 0.005 Å |
| c | 11.615 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 90 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 5880 ± 3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 41 |
| Hermann-Mauguin space group symbol | C 2 e b |
| Hall space group symbol | C -2ac 2 |
| Residual factor for all reflections | 0.0315 |
| Residual factor for significantly intense reflections | 0.028 |
| Weighted residual factors for significantly intense reflections | 0.0759 |
| Weighted residual factors for all reflections included in the refinement | 0.0798 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.9156 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223334 (current) | 2019-11-05 | cif/ Adding structures of 7701682 via cif-deposit CGI script. |
7701682.cif |
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