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Information card for entry 7237701
Preview
| Coordinates | 7237701.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76.5 H61 B Cl Cu N2 P2 |
|---|---|
| Calculated formula | C76.5 H61 B Cl Cu N2 P2 |
| Title of publication | Exploiting synergy between ligand design and counterion interactions to boost room temperature phosphorescence from Cu(i) compounds |
| Authors of publication | Mondal, Rajarshi; Lozada, Issiah B.; Davis, Rebecca L.; Williams, J. A. Gareth; Herbert, David E. |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2019 |
| Journal volume | 7 |
| Journal issue | 13 |
| Pages of publication | 3772 |
| a | 13.9292 ± 0.0006 Å |
| b | 18.462 ± 0.0008 Å |
| c | 25.8326 ± 0.0012 Å |
| α | 107.47 ± 0.003° |
| β | 95.171 ± 0.003° |
| γ | 107.158 ± 0.003° |
| Cell volume | 5937.2 ± 0.5 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.15 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.1157 |
| Weighted residual factors for all reflections included in the refinement | 0.1528 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238538 (current) | 2019-11-24 | cif/ Adding structures of 7237697, 7237698, 7237699, 7237700, 7237701, 7237702, 7237703 via cif-deposit CGI script. |
7237701.cif |
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Users of the data should acknowledge the original authors of the
structural data.