Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
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 |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2243145.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.