Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7040920
Preview
Coordinates | 7040920.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Compound_7 |
---|---|
Formula | C21 H18 F2 Ge |
Calculated formula | C21 H18 F2 Ge |
SMILES | [Ge](CC=C(F)F)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Competing reaction pathways of 3,3,3-trifluoropropene at rhodium hydrido, silyl and germyl complexes: C-F bond activation versus hydrogermylation. |
Authors of publication | Ahrens, Theresia; Teltewskoi, Michael; Ahrens, Mike; Braun, Thomas; Laubenstein, Reik |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 43 |
Pages of publication | 17495 - 17507 |
a | 9.495 ± 0.0004 Å |
b | 9.7733 ± 0.0004 Å |
c | 10.3171 ± 0.0004 Å |
α | 67.024 ± 0.002° |
β | 83.103 ± 0.002° |
γ | 84.211 ± 0.002° |
Cell volume | 873.54 ± 0.06 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0288 |
Residual factor for significantly intense reflections | 0.0261 |
Weighted residual factors for significantly intense reflections | 0.0643 |
Weighted residual factors for all reflections included in the refinement | 0.0657 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
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/7040920.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.