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Information card for entry 1577379
Preview
| Coordinates | 1577379.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C133 H104 Ag6 Au6.39 Cl N5 O3 P6 S5 |
|---|---|
| Calculated formula | C133 H104 Ag6 Au6.982 Cl N5 O3 P6 S5 |
| Title of publication | Enhancing multiphoton absorption in atomically precise (AuAg)<sub>13</sub> clusters <i>via</i> 2-/4-mercaptopyridine ligand positional isomerism. |
| Authors of publication | Xu, Anqi; Wang, Ye; Hu, Daqiao; Li, Shengli; Xiong, Lin; Jin, Shan; Zhang, Qiong; Zhu, Manzhou |
| Journal of publication | Nanoscale |
| Year of publication | 2026 |
| Journal volume | 18 |
| Journal issue | 20 |
| Pages of publication | 10671 - 10681 |
| a | 15.832 ± 0.003 Å |
| b | 16.707 ± 0.003 Å |
| c | 29.996 ± 0.005 Å |
| α | 86.323 ± 0.015° |
| β | 88.797 ± 0.014° |
| γ | 87.481 ± 0.015° |
| Cell volume | 7909 ± 2 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1731 |
| Residual factor for significantly intense reflections | 0.1469 |
| Weighted residual factors for significantly intense reflections | 0.3603 |
| Weighted residual factors for all reflections included in the refinement | 0.3795 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.483 |
| Diffraction radiation wavelength | 1.54186 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306231 (current) | 2026-06-05 | cif/ Adding structures of 1577377, 1577378, 1577379, 1577380 via cif-deposit CGI script. |
1577379.cif |
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Users of the data should acknowledge the original authors of the
structural data.