Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4088854
Preview
| Coordinates | 4088854.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H9 Cl3 Ga O4 Os P |
|---|---|
| Calculated formula | C7 H9 Cl3 Ga O4 Os P |
| SMILES | [Os]([Ga](Cl)(Cl)Cl)([P](C)(C)C)(C#[O])(C#[O])(C#[O])C#[O] |
| Title of publication | Metal-Only Lewis Pairs Based on Zerovalent Osmium |
| Authors of publication | Bissert, Robin; Braunschweig, Holger; Dewhurst, Rian D.; Schneider, Christoph |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 15 |
| Pages of publication | 2567 |
| a | 12.502 ± 0.0005 Å |
| b | 8.8053 ± 0.0003 Å |
| c | 13.5439 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1490.96 ± 0.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0211 |
| Residual factor for significantly intense reflections | 0.0207 |
| Weighted residual factors for significantly intense reflections | 0.0556 |
| Weighted residual factors for all reflections included in the refinement | 0.0564 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.454 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237858 (current) | 2019-11-24 | cif/ Adding structures of 4088852, 4088853, 4088854, 4088855, 4088856, 4088857, 4088858 via cif-deposit CGI script. |
4088854.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.