Information card for entry 4502795
| Common name |
1I, dioxane |
| Chemical name |
1,3,5-triethyl-2,4,6-tris(4-iodophenoxy)methylbenzenes |
| Formula |
C37 H41 I3 O5 |
| Calculated formula |
C37 H41 I3 O5 |
| Title of publication |
Isostructurality in the Guest Free Forms and in the Clathrates of 1,3,5-Triethyl-2,4,6-tris(4-halophenoxy)methylbenzenes |
| Authors of publication |
Bhattacharya, Suman; Saha, Binoy K. |
| Journal of publication |
Crystal Growth & Design |
| Year of publication |
2012 |
| Journal volume |
12 |
| Journal issue |
1 |
| Pages of publication |
169 |
| a |
9.9745 ± 0.0008 Å |
| b |
13.3547 ± 0.0008 Å |
| c |
15.7276 ± 0.0013 Å |
| α |
113.199 ± 0.007° |
| β |
97.615 ± 0.007° |
| γ |
90.585 ± 0.006° |
| Cell volume |
1904.2 ± 0.3 Å3 |
| Cell temperature |
298 ± 2 K |
| Ambient diffraction temperature |
298 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1353 |
| Residual factor for significantly intense reflections |
0.0725 |
| Weighted residual factors for significantly intense reflections |
0.1853 |
| Weighted residual factors for all reflections included in the refinement |
0.2311 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.031 |
| Diffraction radiation wavelength |
0.7107 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/4502795.html
