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Information card for entry 1547537
Preview
| Coordinates | 1547537.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | tBuAuAg51 |
|---|---|
| Formula | C72 H108 Ag1.8 Au10.2 |
| Calculated formula | C72 H108 Ag1.8068 Au10.1932 |
| Title of publication | Assembly of strongly phosphorescent hetero-bimetallic and -trimetallic [2]catenane structures based on a coinage metal alkynyl system |
| Authors of publication | Chang, Xiao-Yong; Xu, Guang-Tao; Cao, Bei; Wang, Juan-Yu; Huang, Jie-Sheng; Che, Chi-Ming |
| Journal of publication | Chem. Sci. |
| Year of publication | 2017 |
| a | 28.818 ± 0.003 Å |
| b | 12.9632 ± 0.0013 Å |
| c | 25.496 ± 0.003 Å |
| α | 90° |
| β | 117.086 ± 0.003° |
| γ | 90° |
| Cell volume | 8480 ± 1.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0886 |
| Residual factor for significantly intense reflections | 0.0866 |
| Weighted residual factors for significantly intense reflections | 0.2404 |
| Weighted residual factors for all reflections included in the refinement | 0.2438 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201668 (current) | 2017-10-04 | cif/ Adding structures of 1547531, 1547532, 1547533, 1547534, 1547535, 1547536, 1547537 via cif-deposit CGI script. |
1547537.cif |
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Users of the data should acknowledge the original authors of the
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