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Information card for entry 2006363
Preview
| Coordinates | 2006363.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | dipotassium(+) bis[1,4,7,10,13,16-hexaoxacyclooctadecane- potassium(+)] hexaselenodistannate (4-) tetraethylenediamine |
|---|---|
| Formula | C32 H80 K4 N8 O12 Se6 Sn2 |
| Calculated formula | C32 H80 K4 N8 O12 Se6 Sn2 |
| SMILES | [K+].[K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6.NCCN.[Se-][Sn]1([Se][Sn]([Se-])([Se-])[Se]1)[Se-].C(CN)N.[K+].[K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6.NCCN.C(CN)N |
| Title of publication | (K^+^)~2~(18-crown-6-K^+^)~2~[Sn~2~Se~6~]^4{-^}.4en: an [Sn~2~Se~6~]^4{-^} Anion with a Short Sn |
| Authors of publication | Borrmann, Horst; Pirani, Ayaaz M.; Schrobilgen, Gary J. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 8 |
| Pages of publication | 1004 - 1006 |
| a | 15.634 ± 0.002 Å |
| b | 8.479 ± 0.001 Å |
| c | 23.404 ± 0.003 Å |
| α | 90° |
| β | 108.6 ± 0.01° |
| γ | 90° |
| Cell volume | 2940.4 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0365 |
| Residual factor for significantly intense reflections | 0.0298 |
| Weighted residual factors for all reflections | 0.08 |
| Weighted residual factors for significantly intense reflections | 0.0753 |
| Goodness-of-fit parameter for all reflections | 1.033 |
| Goodness-of-fit parameter for significantly intense reflections | 1.054 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2006363.html
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