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Information card for entry 2019542
Preview
| Coordinates | 2019542.cif |
|---|---|
| Structure factors | 2019542.hkl |
| Original IUCr paper | HTML |
| Chemical name | Sodium yttrium sulfide |
|---|---|
| Formula | Na S2 Y |
| Calculated formula | Na S2 Y |
| Title of publication | Redetermination of NaGdS~2~, NaLuS~2~ and NaYS~2~ |
| Authors of publication | Fábry, Jan; Havlák, Lubomír; Kučeráková, Monika; Dušek, Michal |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 6 |
| Pages of publication | 533 - 535 |
| a | 3.9604 ± 0.0012 Å |
| b | 3.9604 ± 0.0012 Å |
| c | 19.867 ± 0.008 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 269.86 ± 0.16 Å3 |
| Cell temperature | 301.5 ± 0.3 K |
| Ambient diffraction temperature | 301.5 K |
| Number of distinct elements | 3 |
| Space group number | 166 |
| Hermann-Mauguin space group symbol | R -3 m :H |
| Hall space group symbol | -R 3 2" |
| Residual factor for all reflections | 0.0331 |
| Residual factor for significantly intense reflections | 0.031 |
| Weighted residual factors for significantly intense reflections | 0.067 |
| Weighted residual factors for all reflections included in the refinement | 0.0674 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.78 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181865 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/95. |
2019542.cif 2019542.hkl |
| 180863 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/95. |
2019542.cif 2019542.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2019542.cif 2019542.hkl |
| 119356 | 2014-07-05 | cif/ Updating files of 2019540, 2019541, 2019542 Original log message: Adding full bibliography for 2019540--2019542.cif. |
2019542.cif 2019542.hkl |
| 113044 | 2014-05-08 | cif/ hkl/ Adding structures of 2019540, 2019541, 2019542 via cif-deposit CGI script. |
2019542.cif 2019542.hkl |
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Users of the data should acknowledge the original authors of the
structural data.