Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2016315
Preview
| Coordinates | 2016315.cif |
|---|---|
| Structure factors | 2016315.hkl |
| Original IUCr paper | HTML |
| Common name | bis(μ-tetramethyldistibine)bis(tetracarbonylchromium) |
|---|---|
| Chemical name | 1,1,1,1,4,4,4,4-Octacarbonyl-2,2,3,3,5,5,6,6-octamethyl-cyclo-2,3,5,6- tetraantimony-1,4-dichromium |
| Formula | C16 H24 Cr2 O8 Sb4 |
| Calculated formula | C16 H24 Cr2 O8 Sb4 |
| SMILES | C([Cr]1(C#[O])(C#[O])([Sb](C)(C)[Sb](C)(C)[Cr](C#[O])(C#[O])(C#[O])(C#[O])[Sb](C)(C)[Sb]1(C)C)C#[O])#[O] |
| Title of publication | 1,1,1,1,4,4,4,4-Octacarbonyl-2,2,3,3,5,5,6,6-octamethyl-<i>cyclo</i>-2,3,5,6-tetraantimony-1,4-dichromium |
| Authors of publication | Breunig, Hans Joachim; Lork, Enno; Moldovan, Ovidiu; Raţ, Ciprian I. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2007 |
| Journal volume | 63 |
| Journal issue | 12 |
| Pages of publication | m548 - m549 |
| a | 13.125 ± 0.003 Å |
| b | 11.332 ± 0.002 Å |
| c | 10.185 ± 0.002 Å |
| α | 90° |
| β | 117.91 ± 0.03° |
| γ | 90° |
| Cell volume | 1338.6 ± 0.6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.0313 |
| Residual factor for significantly intense reflections | 0.0237 |
| Weighted residual factors for significantly intense reflections | 0.0534 |
| Weighted residual factors for all reflections included in the refinement | 0.0559 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2016315.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.