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Information card for entry 4348995
Preview
| Coordinates | 4348995.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C123 H100 Cl2 F12 Ir2 N4 O3 P6 |
|---|---|
| Calculated formula | C123 H98 Cl2 F12 Ir2 N4 O3 P6 |
| Title of publication | Enhancing the photoluminescence quantum yields of blue-emitting cationic iridium(iii) complexes bearing bisphosphine ligands |
| Authors of publication | Rota Martir, Diego; Bansal, Ashu K.; Di Mascio, Vincent; Cordes, David B.; Henwood, Adam F.; Slawin, Alexandra M. Z.; Kamer, Paul C. J.; Martínez-Sarti, Laura; Pertegás, Antonio; Bolink, Henk J.; Samuel, Ifor D. W.; Zysman-Colman, Eli |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2016 |
| Journal volume | 3 |
| Journal issue | 2 |
| Pages of publication | 218 |
| a | 11.0741 ± 0.0014 Å |
| b | 21.917 ± 0.003 Å |
| c | 23.797 ± 0.003 Å |
| α | 111.629 ± 0.003° |
| β | 90.278 ± 0.003° |
| γ | 94.509 ± 0.004° |
| Cell volume | 5348.9 ± 1.2 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0811 |
| Residual factor for significantly intense reflections | 0.0591 |
| Weighted residual factors for significantly intense reflections | 0.1593 |
| Weighted residual factors for all reflections included in the refinement | 0.1691 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233536 (current) | 2019-11-23 | cif/ Adding structures of 4348995, 4348996, 4348997, 4348998, 4348999, 4349000, 4349001, 4349002, 4349003 via cif-deposit CGI script. |
4348995.cif |
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Users of the data should acknowledge the original authors of the
structural data.