Information card for entry 7208929
| Formula |
C60 H128 Cl2 N25 O43 Pr |
| Calculated formula |
C60 H64 Cl2 N25 O19 Pr |
| Title of publication |
Macrocycle-based metal ion complexation: a study of the lanthanide contraction effect towards hexacyclohexanocucurbit[6]uil |
| Authors of publication |
Qin, Xiao; Ni, Xin-Long; Hu, Jing-Xu; Chen, Kai; Zhang, Yun-Qian; Redshaw, Carl; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu |
| Journal of publication |
CrystEngComm |
| Year of publication |
2013 |
| Journal volume |
15 |
| Journal issue |
4 |
| Pages of publication |
738 |
| a |
10.6667 ± 0.0008 Å |
| b |
28.785 ± 0.002 Å |
| c |
14.6296 ± 0.0011 Å |
| α |
90° |
| β |
110.47 ± 0.002° |
| γ |
90° |
| Cell volume |
4208.2 ± 0.5 Å3 |
| Cell temperature |
223 ± 2 K |
| Ambient diffraction temperature |
223 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
11 |
| Hermann-Mauguin space group symbol |
P 1 21/m 1 |
| Hall space group symbol |
-P 2yb |
| Residual factor for all reflections |
0.1504 |
| Residual factor for significantly intense reflections |
0.1109 |
| Weighted residual factors for significantly intense reflections |
0.3278 |
| Weighted residual factors for all reflections included in the refinement |
0.3602 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.264 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7208929.html
