Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1567431
Preview
| Coordinates | 1567431.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H13 N S Si |
|---|---|
| Calculated formula | C8 H13 N S Si |
| Title of publication | Molecular Structures of the Silicon Pyridine-2-(thi)olates Me3Si(pyX), Me2Si(pyX)2 and Ph2Si(pyX)2 (py = 2-Pyridyl, X = O, S), and Their Intra- and Intermolecular Ligand Exchange in Solution |
| Authors of publication | Seidel, Anne; Weigel, Mareike; Ehrlich, Lisa; Gericke, Robert; Brendler, Erica; Wagler, Jörg |
| Journal of publication | Crystals |
| Year of publication | 2022 |
| Journal volume | 12 |
| Journal issue | 8 |
| Pages of publication | 1054 |
| a | 6.6079 ± 0.0007 Å |
| b | 7.2078 ± 0.0006 Å |
| c | 11.1025 ± 0.0012 Å |
| α | 90° |
| β | 97.954 ± 0.009° |
| γ | 90° |
| Cell volume | 523.71 ± 0.09 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0354 |
| Residual factor for significantly intense reflections | 0.033 |
| Weighted residual factors for significantly intense reflections | 0.0914 |
| Weighted residual factors for all reflections included in the refinement | 0.0948 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.106 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277147 (current) | 2022-08-06 | cif/ Adding structures of 1567430, 1567431, 1567432, 1567433, 1567434, 1567435, 1567436, 1567437, 1567438 via cif-deposit CGI script. |
1567431.cif |
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.