Information card for entry 7112378
| Formula |
C68 H105 N9 O10 S |
| Calculated formula |
C68 H105 N9 O10 S |
| Title of publication |
Squaramide-based tripodal receptors for selective recognition of sulfate anion. |
| Authors of publication |
Jin, Can; Zhang, Man; Wu, Lin; Guan, Yangfan; Pan, Yi; Jiang, Juli; Lin, Chen; Wang, Leyong |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2013 |
| Journal volume |
49 |
| Journal issue |
20 |
| Pages of publication |
2025 - 2027 |
| a |
12.9919 ± 0.0011 Å |
| b |
14.4679 ± 0.0012 Å |
| c |
19.329 ± 0.0013 Å |
| α |
94.859 ± 0.001° |
| β |
96.631 ± 0.002° |
| γ |
94.257 ± 0.001° |
| Cell volume |
3582.9 ± 0.5 Å3 |
| Cell temperature |
291 ± 2 K |
| Ambient diffraction temperature |
291 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0743 |
| Residual factor for significantly intense reflections |
0.0456 |
| Weighted residual factors for significantly intense reflections |
0.0991 |
| Weighted residual factors for all reflections included in the refinement |
0.1032 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.075 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Duplicate of |
7108906 |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7112378.html
