Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4081893
Preview
Coordinates | 4081893.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H24 Au O9 Os3 P |
---|---|
Calculated formula | C43 H24 Au O9 Os3 P |
SMILES | [Au]1([Os]234([Os]561([Os]2([H]3)(C#[O])(C#[O])(C#[O])[c]16[c]45cc2c3c1ccc1c3c(cc2)ccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])[P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Unsaturated Triosmium Carbonyl Cluster Complexes with Bridging Aryl Ligands: Structures, Bonding, and Transformations |
Authors of publication | Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 21 |
Pages of publication | 6368 |
a | 9.6219 ± 0.0003 Å |
b | 11.2187 ± 0.0003 Å |
c | 19.4363 ± 0.0006 Å |
α | 97.673 ± 0.001° |
β | 100.981 ± 0.001° |
γ | 100.138 ± 0.001° |
Cell volume | 1996.96 ± 0.1 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 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 | 0.0455 |
Residual factor for significantly intense reflections | 0.0334 |
Weighted residual factors for significantly intense reflections | 0.0786 |
Weighted residual factors for all reflections included in the refinement | 0.0923 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4081893.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.