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Information card for entry 1548134
Preview
| Coordinates | 1548134.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C88 H60 F12 N12 O12 Pd2 S8 |
|---|---|
| Calculated formula | C88 H60 F12 N12 O12 Pd2 S8 |
| Title of publication | Molecular cage-bridged plasmonic structures with well-defined nanogaps as well as the capability of reversible and selective guest trapping. |
| Authors of publication | Wang, Chen; Tian, Li; Zhu, Wei; Wang, Shiqiang; Gao, Ning; Zhou, Kang; Yin, Xianpeng; Zhang, Wanlin; Zhao, Liang; Li, Guangtao |
| Journal of publication | Chemical science |
| Year of publication | 2018 |
| Journal volume | 9 |
| Journal issue | 4 |
| Pages of publication | 889 - 895 |
| a | 12.284 ± 0.004 Å |
| b | 15.243 ± 0.005 Å |
| c | 17.55 ± 0.007 Å |
| α | 100.641 ± 0.004° |
| β | 102.198 ± 0.005° |
| γ | 98.202 ± 0.006° |
| Cell volume | 3099.8 ± 1.9 Å3 |
| Cell temperature | 173.15 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1099 |
| Residual factor for significantly intense reflections | 0.0984 |
| Weighted residual factors for significantly intense reflections | 0.2755 |
| Weighted residual factors for all reflections included in the refinement | 0.2873 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.138 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301779 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/54 Each referenced PubChem compound corresponds to the full crystal structure. |
1548134.cif |
| 228718 | 2019-11-17 | cif/ Updating files of 1548134 Original log message: Adding full bibliography for 1548134.cif. |
1548134.cif |
| 203401 | 2017-11-21 | cif/ Adding structures of 1548134 via cif-deposit CGI script. |
1548134.cif |
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Users of the data should acknowledge the original authors of the
structural data.