Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7053535
Preview
Coordinates | 7053535.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H49 Ge N O2 S Si3 W |
---|---|
Calculated formula | C29 H48 Ge N O2 S Si3 W |
SMILES | [W]12345([Ge](N(C=[S]1)c1ccccc1)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C#[O])(C#[O])[c]1([c]5([c]4([c]3([c]21C)C)C)C)C |
Title of publication | Reactions of a hydrido(hydrogermylene)tungsten complex with some heterocumulenes: hydrogermylation and thermal rearrangement |
Authors of publication | Hashimoto, Hisako; Fukuda, Tetsuya; Tobita, Hiromi |
Journal of publication | New Journal of Chemistry |
Year of publication | 2010 |
Journal volume | 34 |
Journal issue | 8 |
Pages of publication | 1723 |
a | 12.824 ± 0.0006 Å |
b | 16.7658 ± 0.0005 Å |
c | 17.575 ± 0.0006 Å |
α | 90° |
β | 108.991 ± 0.0009° |
γ | 90° |
Cell volume | 3573 ± 0.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0285 |
Residual factor for significantly intense reflections | 0.024 |
Weighted residual factors for significantly intense reflections | 0.0746 |
Weighted residual factors for all reflections included in the refinement | 0.0801 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.267 |
Diffraction radiation wavelength | 0.71069 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/7053535.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.