Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4067900
Preview
| Coordinates | 4067900.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H28 N2 O11 Te2 |
|---|---|
| Calculated formula | C24 H28 N2 O11 Te2 |
| SMILES | c1c2[N]([Te](O[Te]3(O)(=O)(O)[N](c4cccc5cccc3c45)(C)C)(=O)(O)(O)c3c2c(ccc3)cc1)(C)C.O.O.O.O |
| Title of publication | Synthesis and Structure of an Intramolecularly Coordinated Diaryltelluronic Acid and Its Dimethyl Ester |
| Authors of publication | Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela |
| Journal of publication | Organometallics |
| Year of publication | 2012 |
| Journal volume | 31 |
| Journal issue | 1 |
| Pages of publication | 289 |
| a | 10.808 ± 0.012 Å |
| b | 10.936 ± 0.012 Å |
| c | 12.702 ± 0.011 Å |
| α | 108.88 ± 0.08° |
| β | 90.79 ± 0.08° |
| γ | 95.28 ± 0.09° |
| Cell volume | 1413 ± 3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0523 |
| Residual factor for significantly intense reflections | 0.0334 |
| Weighted residual factors for significantly intense reflections | 0.0779 |
| Weighted residual factors for all reflections included in the refinement | 0.0945 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.932 |
| 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/4067900.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.