Information card for entry 7123775
| Formula |
C129 H50 N4 Ni S2 Th |
| Calculated formula |
C129 H50 N4 Ni S2 Th |
| Title of publication |
Th@C1(11)-C86： Actinide Encapsulated in an Unexpected C86 Fullerene Cage |
| Authors of publication |
Chen, Ning; Wang, Yaofeng; Morales-Martínez, Roser; Cai, Wenting; Zhuang, Jiaxin; Yang, Wei; Echegoyen, Luis; Poblet, Josep M.; Rodriguez-Fortea, Antonio |
| Journal of publication |
Chemical Communications |
| Year of publication |
2019 |
| a |
25.521 ± 0.0013 Å |
| b |
15.0899 ± 0.0013 Å |
| c |
19.9828 ± 0.0012 Å |
| α |
90° |
| β |
94.334 ± 0.003° |
| γ |
90° |
| Cell volume |
7673.6 ± 0.9 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
12 |
| Hermann-Mauguin space group symbol |
C 1 2/m 1 |
| Hall space group symbol |
-C 2y |
| Residual factor for all reflections |
0.116 |
| Residual factor for significantly intense reflections |
0.0815 |
| Weighted residual factors for significantly intense reflections |
0.2421 |
| Weighted residual factors for all reflections included in the refinement |
0.2724 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.061 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7123775.html
