Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2008953
Preview
Coordinates | 2008953.cif |
---|---|
Original IUCr paper | HTML |
Common name | [bis(2,2'-bipyridine)(pyridine-2-carboxylato)ruthenium(II)] hexafluorophosphate |
---|---|
Chemical name | [bis(2,2'-bipyridine)(pyridine-2-carboxylato)ruthenium(II)] hexafluorophosphate |
Formula | C26 H20 F6 N5 O2 P Ru |
Calculated formula | C26 H20 F6 N5 O2 P Ru |
SMILES | [Ru]123([n]4c(cccc4)C(=O)O1)([n]1c(cccc1)c1[n]2cccc1)[n]1c(cccc1)c1[n]3cccc1.[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Bis(2,2'-bipyridine)(pyridine-2-carboxylate)ruthenium(II) hexafluorophosphate at 173K |
Authors of publication | Lashgari, Kianosh; Norrestam, Rolf; Åkermark, Björn |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 9 |
Pages of publication | IUC9900108 |
a | 14.373 ± 0.007 Å |
b | 11.078 ± 0.007 Å |
c | 16.788 ± 0.008 Å |
α | 90° |
β | 107.67 ± 0.05° |
γ | 90° |
Cell volume | 2547 ± 2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
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 | 0.062 |
Residual factor for significantly intense reflections | 0.036 |
Weighted residual factors for all reflections included in the refinement | 0.105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
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/2008953.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.