Information card for entry 7228860
| Common name |
JACQ02 Quasiracemate, 2R,4R AND 2R,4S nor methyl analogues0.33 Tetrachloromethane solvate |
| Chemical name |
2R,4R-4-p-hydroxyphenyl-2,4-dimethylchroman,2R,4S-4-p-hydroxyphenyl-2,4-dimethylchroman.0.33 Tetrachloromethane solvate |
| Formula |
C103 H108 Cl4 O12 |
| Calculated formula |
C103 H108 Cl4 O12 |
| Title of publication |
Total CCl4 guest alignment in a quasiracemic clathrate closely related to Dianin’s compound |
| Authors of publication |
Frampton, Christopher Stephen; Gall, James H.; MacNicol, David D. |
| Journal of publication |
CrystEngComm |
| Year of publication |
2017 |
| a |
26.3307 ± 0.0003 Å |
| b |
26.3307 ± 0.0003 Å |
| c |
11.1874 ± 0.0003 Å |
| α |
90° |
| β |
90° |
| γ |
120° |
| Cell volume |
6717.1 ± 0.2 Å3 |
| Cell temperature |
100 ± 1 K |
| Ambient diffraction temperature |
100 ± 1 K |
| Number of distinct elements |
4 |
| Space group number |
146 |
| Hermann-Mauguin space group symbol |
R 3 :H |
| Hall space group symbol |
R 3 |
| Residual factor for all reflections |
0.0493 |
| Residual factor for significantly intense reflections |
0.0489 |
| Weighted residual factors for significantly intense reflections |
0.1353 |
| Weighted residual factors for all reflections included in the refinement |
0.1363 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.061 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7228860.html
