Information card for entry 7120450
| Formula |
C86 H154 N2 O11 Si6 Sm3 |
| Calculated formula |
C86 H154 N2 O11 Si6 Sm3 |
| Title of publication |
Synthesis of Rare-Earth-Metal-in-Cryptand Dications, [Ln(2.2.2-cryptand)]2+, from Sm2+, Eu2+, and Yb2+ Silyl Metallocenes (C5H4SiMe3)2Ln(THF)2 |
| Authors of publication |
Huh, Daniel N.; Kotyk, Christopher Matthew; Gembicky, Milan; Rheingold, Arnold L.; Ziller, Joseph W.; Evans, William J. |
| Journal of publication |
Chem. Commun. |
| Year of publication |
2017 |
| a |
16.635 ± 0.002 Å |
| b |
24.176 ± 0.003 Å |
| c |
27.798 ± 0.004 Å |
| α |
112.104 ± 0.0015° |
| β |
94.405 ± 0.0016° |
| γ |
104.106 ± 0.0016° |
| Cell volume |
9867 ± 2 Å3 |
| Cell temperature |
88 ± 2 K |
| Ambient diffraction temperature |
88 ± 2 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 |
0.1798 |
| Residual factor for significantly intense reflections |
0.0674 |
| Weighted residual factors for significantly intense reflections |
0.1079 |
| Weighted residual factors for all reflections included in the refinement |
0.1442 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.941 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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