Information card for entry 7238800
| Formula |
C68 H92 N12 O4 S4 |
| Calculated formula |
C68 H92 N12 O4 S4 |
| Title of publication |
Novel 1,3-alternate thiacalix[4]arenes: click synthesis, silver ion binding and self-assembly |
| Authors of publication |
Zhao, Haiyang; Zhan, Junyan; Zou, Zhilong; Miao, Fajun; Chen, Hong; Zhang, Li; Cao, Xianliang; Tian, Deimei; Li, Haibing |
| Journal of publication |
RSC Adv. |
| Year of publication |
2013 |
| Journal volume |
3 |
| Journal issue |
4 |
| Pages of publication |
1029 |
| a |
13.9744 ± 0.0004 Å |
| b |
14.0021 ± 0.0004 Å |
| c |
19.6538 ± 0.0008 Å |
| α |
72.123 ± 0.001° |
| β |
81.273 ± 0.001° |
| γ |
79.907 ± 0.001° |
| Cell volume |
3583.6 ± 0.2 Å3 |
| Cell temperature |
298 ± 2 K |
| Ambient diffraction temperature |
298 ± 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 |
0.0827 |
| Residual factor for significantly intense reflections |
0.0595 |
| Weighted residual factors for significantly intense reflections |
0.1702 |
| Weighted residual factors for all reflections included in the refinement |
0.1836 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.002 |
| 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/7238800.html
