Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7002046
Preview
Coordinates | 7002046.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H25 Cl3 N3 Rh |
---|---|
Calculated formula | C25 H25 Cl3 N3 Rh |
SMILES | [Rh]123(Cl)(=C4N(N=C5N4c4c(C=C5)cccc4)c4ccccc4)[CH]4CC[CH]1=[CH]2CC[CH]3=4.ClCCl |
Title of publication | Synthesis, structure and properties of [1,2,4]triazolo[4,3-a]pyridin-3-ylidene rhodium and palladium complexes |
Authors of publication | Iglesias-Sigüenza, Javier; Ros, Abel; Díez, Elena; Alcarazo, Manuel; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 35 |
Pages of publication | 7113 |
a | 11.2461 ± 0.0005 Å |
b | 20.3332 ± 0.0009 Å |
c | 20.7475 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4744.3 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0608 |
Residual factor for significantly intense reflections | 0.0494 |
Weighted residual factors for significantly intense reflections | 0.1317 |
Weighted residual factors for all reflections included in the refinement | 0.1397 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
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/7002046.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.