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Information card for entry 2232496
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| Coordinates | 2232496.cif |
|---|---|
| Structure factors | 2232496.hkl |
| Original IUCr paper | HTML |
| Chemical name | tetracopper dicadmium hexadecaarsenide |
|---|---|
| Formula | As16 Cd1.65 Cu4.35 |
| Calculated formula | As16 Cd1.652 Cu4.348 |
| Title of publication | Cu~4.35~Cd~1.65~As~16~: the first polyarsenic compound in the Cu‒Cd‒As system |
| Authors of publication | Osters, Oliver; Nilges, Tom |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 11 |
| Pages of publication | i62 |
| a | 11.8324 ± 0.0006 Å |
| b | 10.4423 ± 0.0004 Å |
| c | 8.0903 ± 0.0004 Å |
| α | 90° |
| β | 110.48 ± 0.004° |
| γ | 90° |
| Cell volume | 936.44 ± 0.08 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 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 |
| Residual factor for all reflections | 0.0464 |
| Residual factor for significantly intense reflections | 0.0355 |
| Weighted residual factors for significantly intense reflections | 0.0693 |
| Weighted residual factors for all reflections included in the refinement | 0.0721 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.83 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181246 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/24. |
2232496.cif 2232496.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2232496.cif 2232496.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2232496.cif 2232496.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2232496.cif 2232496.hkl |
| 31968 | 2012-01-03 | hkl/ Adding automatically assigned IUCr Fobs data for the rest of the year 2001 structures. |
2232496.cif 2232496.hkl |
| 31168 | 2011-12-12 | ../uploads/cif-deposit/cod/cif Adding structures of 2232496 via cif-deposit CGI script. |
2232496.cif |
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Users of the data should acknowledge the original authors of the
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