Information card for entry 1558322
| Common name |
sql-1,3-Co-NCS.2MX |
| Formula |
C40 H36 Co N10 S2 |
| Calculated formula |
C40 H36 Co N10 S2 |
| Title of publication |
Crystal engineering of a rectangular sql coordination network to enable xylenes selectivity over ethylbenzene |
| Authors of publication |
Zaworotko, Michael; Kumar, Naveen; Chang, Ze; Yu, Mei-Hui; Kumar, Amrit; O’Nolan, Daniel; Bu, Xian-He; Patyk-Kaźmierczak, Ewa; Bezrukov, Andrey A.; Mukherjee, Soumya; Wang, Shi-Qiang |
| Journal of publication |
Chemical Science |
| Year of publication |
2020 |
| a |
24.756 ± 0.002 Å |
| b |
11.4713 ± 0.0009 Å |
| c |
14.4235 ± 0.0013 Å |
| α |
90° |
| β |
100.226 ± 0.004° |
| γ |
90° |
| Cell volume |
4031 ± 0.6 Å3 |
| Cell temperature |
298 ± 2 K |
| Ambient diffraction temperature |
298.32 K |
| Number of distinct elements |
5 |
| Space group number |
15 |
| Hermann-Mauguin space group symbol |
C 1 2/c 1 |
| Hall space group symbol |
-C 2yc |
| Residual factor for all reflections |
0.0678 |
| Residual factor for significantly intense reflections |
0.0557 |
| Weighted residual factors for significantly intense reflections |
0.1084 |
| Weighted residual factors for all reflections included in the refinement |
0.1118 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.188 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1558322.html
