Information card for entry 7030006
| Formula |
C25 H20 O Se Te |
| Calculated formula |
C25 H20 O Se Te |
| SMILES |
[Te](c1ccc2c3c(ccc([Se]c4ccccc4)c13)CC2)c1c(OC)cccc1 |
| Title of publication |
Probing interactions through space using spin-spin coupling. |
| Authors of publication |
Stanford, Martin W.; Knight, Fergus R.; Athukorala Arachchige, Kasun S.; Sanz Camacho, Paula; Ashbrook, Sharon E.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2014 |
| Journal volume |
43 |
| Journal issue |
17 |
| Pages of publication |
6548 - 6560 |
| a |
8.645 ± 0.004 Å |
| b |
14.625 ± 0.007 Å |
| c |
17.253 ± 0.009 Å |
| α |
109.466 ± 0.012° |
| β |
97.975 ± 0.01° |
| γ |
93.276 ± 0.006° |
| Cell volume |
2024.3 ± 1.7 Å3 |
| Cell temperature |
125 K |
| Ambient diffraction temperature |
125 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 significantly intense reflections |
0.0655 |
| Weighted residual factors for all reflections included in the refinement |
0.2857 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.226 |
| Diffraction radiation wavelength |
0.71075 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7030006.html
