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Information card for entry 1518040
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| Coordinates | 1518040.cif |
|---|
| Formula | Ba3 Ga2 S6 |
|---|---|
| Calculated formula | Ba6 Ga4 S12 |
| SMILES | [Ba+2].S1[Ga]([S-])([S-])S[Ga]1([S-])[S-].[Ba+2].[Ba+2] |
| Title of publication | Darstellung und kristallstruktur von Ba4Ga2S7 und Ba3Ga2S6 |
| Authors of publication | Eisenmann, Brigitte; Jakowski, Mareike; Schafer, Herbert |
| Journal of publication | Revue de Chimie Minerale |
| Year of publication | 1984 |
| Journal volume | 21 |
| Pages of publication | 12 - 20 |
| a | 9.089 ± 0.005 Å |
| b | 14.477 ± 0.004 Å |
| c | 9.028 ± 0.004 Å |
| α | 90° |
| β | 91.81 ± 0.06° |
| γ | 90° |
| Cell volume | 1187.3 ± 0.9 Å3 |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Weighted residual factors for significantly intense reflections | 0.046 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 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. |
1518040.cif |
| 125480 | 2014-10-16 | cif/ Adding structures of 1518040 via cif-deposit CGI script. |
1518040.cif |
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Users of the data should acknowledge the original authors of the
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