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Information card for entry 2241174
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| Coordinates | 2241174.cif |
|---|---|
| Structure factors | 2241174.hkl |
| Original IUCr paper | HTML |
| Chemical name | Di-μ-iodido-bis[bis(acetonitrile-κ<i>N</i>)copper(I)] |
|---|---|
| Formula | C8 H12 Cu2 I2 N4 |
| Calculated formula | C8 H12 Cu2 I2 N4 |
| SMILES | C(C)#[N][Cu]12([N]#CC)[I][Cu]2([I]1)([N]#CC)[N]#CC |
| Title of publication | Crystal structure of di-μ-iodido-bis[bis(acetonitrile-κ<i>N</i>)copper(I)] |
| Authors of publication | Barth, Eva Rebecca; Golz, Christopher; Knorr, Michael; Strohmann, Carsten |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 11 |
| Pages of publication | m189 - m190 |
| a | 7.669 ± 0.003 Å |
| b | 14.367 ± 0.005 Å |
| c | 7.944 ± 0.003 Å |
| α | 90° |
| β | 116.957 ± 0.005° |
| γ | 90° |
| Cell volume | 780.2 ± 0.5 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0223 |
| Residual factor for significantly intense reflections | 0.0213 |
| Weighted residual factors for significantly intense reflections | 0.0554 |
| Weighted residual factors for all reflections included in the refinement | 0.0558 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.158 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181912 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/11. |
2241174.cif 2241174.hkl |
| 159556 | 2015-10-03 | cif/ hkl/ Adding structures of 2241174 via cif-deposit CGI script. |
2241174.cif 2241174.hkl |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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Users of the data should acknowledge the original authors of the
structural data.