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Information card for entry 1558086
Preview
| Coordinates | 1558086.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C124 H150 Au13 P3 Pd S7 |
|---|---|
| Calculated formula | C124 H150 Au13 P3 Pd S7 |
| Title of publication | The synthesis and structure of the [PdAu<sub>13</sub>(PPh<sub>3</sub>)<sub>3</sub>(SR)<sub>7</sub>]<sup>+</sup> nanocluster. |
| Authors of publication | Fu, Xuemei; Lin, Xinzhang; Ren, Xiuqing; Wu, Ren'an; Liu, Chao; Huang, Jiahui |
| Journal of publication | Nanoscale |
| Year of publication | 2020 |
| Journal volume | 12 |
| Journal issue | 22 |
| Pages of publication | 11825 - 11829 |
| a | 17.1801 ± 0.0005 Å |
| b | 17.7175 ± 0.0005 Å |
| c | 22.9577 ± 0.0007 Å |
| α | 95.508 ± 0.002° |
| β | 90.634 ± 0.002° |
| γ | 106.355 ± 0.002° |
| Cell volume | 6669 ± 0.3 Å3 |
| Cell temperature | 173.01 K |
| Ambient diffraction temperature | 173.01 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1111 |
| Residual factor for significantly intense reflections | 0.0818 |
| Weighted residual factors for significantly intense reflections | 0.2063 |
| Weighted residual factors for all reflections included in the refinement | 0.2372 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301780 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure. |
1558086.cif |
| 253932 | 2020-07-06 | cif/ Updating files of 1558086 Original log message: Adding full bibliography for 1558086.cif. |
1558086.cif |
| 252198 | 2020-05-20 | cif/ Adding structures of 1558086 via cif-deposit CGI script. |
1558086.cif |
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Users of the data should acknowledge the original authors of the
structural data.