Information card for entry 7245807
| Formula |
C44 H76 N26 O34 P2 |
| Calculated formula |
C44 H75 N26 O34 P2 |
| Title of publication |
Host-guest inclusion complexes formed between a symmetrical tetrasubstituted cucurbit[6]uril and glycine |
| Authors of publication |
Yuan, Shang-Wei; Shan, Pei-Hui; Yang, Mao Xia; Ma, PeiHua; Prior, Timothy J.; Redshaw, Carl; Wei, Gang; Tao, Zhu; Xiao, Xin |
| Journal of publication |
CrystEngComm |
| Year of publication |
2022 |
| a |
12.878 ± 0.003 Å |
| b |
20.372 ± 0.005 Å |
| c |
12.609 ± 0.005 Å |
| α |
90° |
| β |
106.828 ± 0.006° |
| γ |
90° |
| Cell volume |
3166.3 ± 1.7 Å3 |
| Cell temperature |
296 ± 2 K |
| Ambient diffraction temperature |
296 K |
| Number of distinct elements |
5 |
| 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 |
0.0556 |
| Residual factor for significantly intense reflections |
0.0394 |
| Weighted residual factors for significantly intense reflections |
0.1031 |
| Weighted residual factors for all reflections included in the refinement |
0.1126 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.042 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7245807.html
