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Information card for entry 1574589
Preview
| Coordinates | 1574589.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H54 Cl2 N6 Pd2 |
|---|---|
| Calculated formula | C53 H40 Cl2 N6 Pd2 |
| Title of publication | 3MMLCT excited states of luminescent binuclear PdII complexes: excited state inner-sphere electron-transfer reactions and application |
| Authors of publication | Che, Chi-Ming; Xue, Minying; To, Wai-Pong; Cheng, Gang; Zhang, Yuzhen; Tang, Zhou; Du, Lili; Low, Kam-Hung; Wan, Qingyun |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 12.4062 ± 0.0018 Å |
| b | 12.6181 ± 0.0018 Å |
| c | 19.276 ± 0.003 Å |
| α | 102.182 ± 0.004° |
| β | 95.522 ± 0.004° |
| γ | 118.581 ± 0.003° |
| Cell volume | 2520.9 ± 0.7 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.1496 |
| Residual factor for significantly intense reflections | 0.0545 |
| Weighted residual factors for significantly intense reflections | 0.1021 |
| Weighted residual factors for all reflections included in the refinement | 0.13 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.977 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299580 (current) | 2025-05-09 | cif/ Adding structures of 1574586, 1574587, 1574588, 1574589, 1574590, 1574591 via cif-deposit CGI script. |
1574589.cif |
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Users of the data should acknowledge the original authors of the
structural data.