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Information card for entry 1574587
Preview
| Coordinates | 1574587.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C80 H98 N6 Pt2 |
|---|---|
| Calculated formula | C68 H70 N6 Pt2 |
| 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 | 17.465 ± 0.014 Å |
| b | 19.39 ± 0.013 Å |
| c | 20.394 ± 0.017 Å |
| α | 90° |
| β | 97.86 ± 0.02° |
| γ | 90° |
| Cell volume | 6841 ± 9 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0935 |
| Residual factor for significantly intense reflections | 0.0445 |
| Weighted residual factors for significantly intense reflections | 0.0822 |
| Weighted residual factors for all reflections included in the refinement | 0.0985 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
1574587.cif |
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Users of the data should acknowledge the original authors of the
structural data.