Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4088852
Preview
| Coordinates | 4088852.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H24 N2 O4 Os |
|---|---|
| Calculated formula | C25 H24 N2 O4 Os |
| SMILES | C(#[O])[Os](C#[O])(C#[O])(=C1N(C=CN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)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 | 15.8145 ± 0.0009 Å |
| b | 19.413 ± 0.008 Å |
| c | 7.594 ± 0.01 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2331 ± 3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0156 |
| Residual factor for significantly intense reflections | 0.0138 |
| Weighted residual factors for significantly intense reflections | 0.032 |
| Weighted residual factors for all reflections included in the refinement | 0.0329 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.111 |
| 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. |
4088852.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.