Information card for entry 7030010
| Formula |
C28 H20 Se Te |
| Calculated formula |
C28 H20 Se Te |
| SMILES |
[Te](c1ccc2c3c(ccc([Se]c4ccccc4)c13)CC2)c1cccc2ccccc12 |
| 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 |
29.375 ± 0.003 Å |
| b |
7.6824 ± 0.0008 Å |
| c |
19.0439 ± 0.0019 Å |
| α |
90° |
| β |
95.737 ± 0.007° |
| γ |
90° |
| Cell volume |
4276.1 ± 0.8 Å3 |
| Cell temperature |
125 K |
| Ambient diffraction temperature |
125 K |
| Number of distinct elements |
4 |
| Space group number |
15 |
| Hermann-Mauguin space group symbol |
C 1 2/c 1 |
| Hall space group symbol |
-C 2yc |
| Residual factor for significantly intense reflections |
0.0248 |
| Weighted residual factors for all reflections included in the refinement |
0.0539 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.097 |
| Diffraction radiation wavelength |
0.71075 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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