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Information card for entry 2243971
Preview
| Coordinates | 2243971.cif |
|---|---|
| Structure factors | 2243971.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(4-bromo-1,3-diethylimidazol-2-ylidene)gold(I) iodide |
|---|---|
| Formula | C14 H22 Au Br2 I N4 |
| Calculated formula | C14 H22 Au Br2 I N4 |
| Title of publication | Crystal structures of the gold NHC complex bis(4-bromo-1,3-diethylimidazol-2-ylidene)gold(I) iodide and its 1:1 adduct with <i>trans</i>-bis(4-bromo-1,3-diethyl-imidazol-2-ylidene)diiodidogold(III) iodide |
| Authors of publication | Büssing, Rolf; Ott, Ingo; Jones, Peter G. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 12 |
| Pages of publication | 1249 - 1252 |
| a | 8.4676 ± 0.0002 Å |
| b | 8.8248 ± 0.0003 Å |
| c | 14.0119 ± 0.0005 Å |
| α | 76.374 ± 0.003° |
| β | 85.32 ± 0.002° |
| γ | 85.251 ± 0.002° |
| Cell volume | 1011.99 ± 0.06 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0313 |
| Residual factor for significantly intense reflections | 0.0233 |
| Weighted residual factors for significantly intense reflections | 0.0502 |
| Weighted residual factors for all reflections included in the refinement | 0.0519 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271894 (current) | 2022-01-07 | cif/ hkl/ Adding structures of 2243971, 2243972 via cif-deposit CGI script. |
2243971.cif 2243971.hkl |
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Users of the data should acknowledge the original authors of the
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