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Information card for entry 1574089
Preview
| Coordinates | 1574089.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | salt [1](I)2 |
|---|---|
| Formula | C39 H42 I2 N6 O4 |
| Calculated formula | C39 H42 I2 N6 O4 |
| Title of publication | Fluoride-induced redox-switchable behaviour of a palladium (II)/(IV) couple |
| Authors of publication | Martinez Vivas, Sebastian; Poyatos, Macarena; Peris, Eduardo |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 14.2539 ± 0.0012 Å |
| b | 17.2346 ± 0.0016 Å |
| c | 17.3593 ± 0.0017 Å |
| α | 106.528 ± 0.003° |
| β | 102.26 ± 0.003° |
| γ | 90.213 ± 0.003° |
| Cell volume | 3985.7 ± 0.6 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0799 |
| Residual factor for significantly intense reflections | 0.0706 |
| Weighted residual factors for significantly intense reflections | 0.1776 |
| Weighted residual factors for all reflections included in the refinement | 0.1843 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298337 (current) | 2025-03-08 | cif/ Adding structures of 1574089, 1574090, 1574091 via cif-deposit CGI script. |
1574089.cif |
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Users of the data should acknowledge the original authors of the
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