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Information card for entry 2237813
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| Coordinates | 2237813.cif |
|---|---|
| Structure factors | 2237813.hkl |
| Original IUCr paper | HTML |
| Chemical name | Tetraammine-2κ^4^<i>C</i>-μ-cyanido-1:2κ^2^<i>C</i>:<i>N</i>-tricyanido-1κ^3^<i>C</i>-copper(II)palladium(II) |
|---|---|
| Formula | C4 H12 Cu N8 Pd |
| Calculated formula | C4 H12 Cu N8 Pd |
| SMILES | C(#N)[Pd](C#N)(C#[N][Cu]([NH3])([NH3])([NH3])[NH3])C#N |
| Title of publication | Tetraammine-2κ^4^<i>C</i>-μ-cyanido-1:2κ^2^<i>C</i>:<i>N</i>-tricyanido-1κ^3^<i>C</i>-copper(II)palladium(II) |
| Authors of publication | Suchá, Veronika; Kuchár, Juraj; Harms, Klaus |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 5 |
| Pages of publication | i32 |
| a | 14.5204 ± 0.0009 Å |
| b | 7.2358 ± 0.0005 Å |
| c | 10.3955 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1092.22 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0278 |
| Residual factor for significantly intense reflections | 0.0247 |
| Weighted residual factors for significantly intense reflections | 0.0604 |
| Weighted residual factors for all reflections included in the refinement | 0.0611 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181300 (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 2/23/78. |
2237813.cif 2237813.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. |
2237813.cif 2237813.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2237813.cif 2237813.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2237813.cif 2237813.hkl |
| 86484 | 2013-07-11 | cif/ Adding structures of 2237813 via cif-deposit CGI script. |
2237813.cif |
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Users of the data should acknowledge the original authors of the
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