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Information card for entry 2243145
Preview
| Coordinates | 2243145.cif |
|---|---|
| Structure factors | 2243145.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(μ-1,3-dibenzyl-4,5-diphenyl-2-selenoimidazole-κ^2^<i>Se</i>:<i>Se</i>)bis[bromido(1,3-dibenzyl-4,5-diphenyl-2-selenoimidazole-κ<i>Se</i>)silver(I)] dichloromethane hexasolvate |
|---|---|
| Formula | C122 H108 Ag2 Br2 Cl12 N8 Se4 |
| Calculated formula | C120 H104 Ag2 Br2 Cl8 N8 Se4 |
| Title of publication | Unexpected reactions of NHC*—Cu^I^ and —Ag^I^ bromides with potassium thio- or selenocyanate |
| Authors of publication | Tacke, Matthias; Marhöfer, Daniel; Althani, Hessah; Müller-Bunz, Helge |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 11 |
| Pages of publication | 1657 - 1663 |
| a | 13.6265 ± 0.0001 Å |
| b | 14.7422 ± 0.0001 Å |
| c | 16.9397 ± 0.0002 Å |
| α | 106.417 ± 0.0007° |
| β | 112.282 ± 0.0008° |
| γ | 96.2211 ± 0.0006° |
| Cell volume | 2930.05 ± 0.05 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0406 |
| Residual factor for significantly intense reflections | 0.0348 |
| Weighted residual factors for significantly intense reflections | 0.0915 |
| Weighted residual factors for all reflections included in the refinement | 0.0959 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 219488 (current) | 2019-10-24 | cif/ hkl/ Adding structures of 2243144, 2243145, 2243146 via cif-deposit CGI script. |
2243145.cif 2243145.hkl |
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Users of the data should acknowledge the original authors of the
structural data.