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Information card for entry 4300059
Preview
| Coordinates | 4300059.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Cesium hexaiodopalladate |
|---|---|
| Formula | Cs2 I6 Pd |
| Calculated formula | Cs2 I6 Pd |
| SMILES | I[Pd](I)(I)(I)([I-])[I-].[Cs+].[Cs+] |
| Title of publication | Crystal Structures and Pressure-Induced Redox Reaction of Cs2PdI4.I2 to Cs2PdI6 |
| Authors of publication | B. Schüpp; P. Heines; A. Savin; H.-L. Keller |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2000 |
| Journal volume | 39 |
| Pages of publication | 732 - 735 |
| a | 11.332 ± 0.001 Å |
| b | 11.332 ± 0.001 Å |
| c | 11.332 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1455.2 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for significantly intense reflections | 0.0327 |
| Weighted residual factors for significantly intense reflections | 0.0832 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277859 (current) | 2022-09-15 | cif/ Added space group information derived from the space group operation list using the 'cif_filter' program. |
4300059.cif |
| 277857 | 2022-09-15 | cif/ Reordered data items using the 'cif_filter' program to ensure that future changes to the file result in a minimal number of modified lines. |
4300059.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4300059.cif |
| 62033 | 2012-07-06 | smi/7 Adding SMILES for misc. B-containing compounds |
4300059.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4300059.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
4300059.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
4300059.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
4300059.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
4300059.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
4300059.cif |
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Users of the data should acknowledge the original authors of the
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