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Information card for entry 2238732
Preview
| Coordinates | 2238732.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | Triphenyltelluronium(IV) bromide acetone hemisolvate |
|---|---|
| Formula | C39 H36 Br2 O Te2 |
| Calculated formula | C39 H36 Br2 O Te2 |
| Title of publication | Triphenyltelluronium(IV) bromide acetone hemisolvate |
| Authors of publication | Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 11 |
| Pages of publication | o1666 |
| a | 11.753 ± 0.002 Å |
| b | 13.086 ± 0.003 Å |
| c | 13.165 ± 0.003 Å |
| α | 77.69 ± 0.03° |
| β | 66.05 ± 0.03° |
| γ | 81.73 ± 0.03° |
| Cell volume | 1804.2 ± 0.8 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 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 all reflections | 0.0458 |
| Residual factor for significantly intense reflections | 0.0374 |
| Weighted residual factors for significantly intense reflections | 0.0996 |
| Weighted residual factors for all reflections included in the refinement | 0.1061 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301806 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/23 Each referenced PubChem compound corresponds to the full crystal structure. |
2238732.cif |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2238732.cif |
| 91140 | 2013-12-09 | cif/ Adding structures of 2238732 via cif-deposit CGI script. |
2238732.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.