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Information card for entry 1519091
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| Coordinates | 1519091.cif |
|---|
| Formula | K4 Nb2 S9.5 Se1.5 |
|---|---|
| Calculated formula | K4 Nb2 S9.54 Se1.46 |
| Title of publication | Chemical reactivity of the [Nb2S11]4- anion: selective substitution of sulfur by selenium on a molecular level |
| Authors of publication | Oliver Krause; Peter Durichen; Christian Nather; Wolfgang Bensch |
| Journal of publication | Solid State Sciences |
| Year of publication | 2000 |
| Journal volume | 2 |
| Pages of publication | 197 - 203 |
| a | 8.016 ± 0.001 Å |
| b | 8.788 ± 0.001 Å |
| c | 13.186 ± 0.001 Å |
| α | 71.42 ± 0.01° |
| β | 89.16 ± 0.01° |
| γ | 86.49 ± 0.01° |
| Cell volume | 878.81 ± 0.17 Å3 |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.0494 |
| Weighted residual factors for significantly intense reflections | 0.1311 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1519091.cif |
| 135369 | 2015-04-27 | cif/ Adding structures of 1519091 via cif-deposit CGI script. |
1519091.cif |
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Users of the data should acknowledge the original authors of the
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