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Information card for entry 2237270
Preview
Coordinates | 2237270.cif |
---|---|
Structure factors | 2237270.hkl |
Original IUCr paper | HTML |
Chemical name | <i>cis</i>-Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine- κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate) acetonitrile monosolvate |
---|---|
Formula | C32 H31 F12 N9 P2 Ru |
Calculated formula | C32 H31 F12 N9 P2 Ru |
SMILES | [Ru]12([n]3ccccc3c3[n]1cccc3)([n]1ccccc1c1[n]2cccc1)([n]1ccc(N)cc1)[n]1ccc(N)cc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].CC#N |
Title of publication | <i>cis</i>-Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(pyridin-4-amine-κ<i>N</i>^1^)ruthenium(II) bis(hexafluoridophosphate) acetonitrile monosolvate |
Authors of publication | Camilo, Mariana R.; Martins, Felipe T.; Malta, Valéria R. S.; Ellena, Javier; Carlos, Rose M. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 2 |
Pages of publication | m77 - m78 |
a | 10.829 ± 0.0003 Å |
b | 11.889 ± 0.0003 Å |
c | 16.102 ± 0.0004 Å |
α | 104.073 ± 0.001° |
β | 99.114 ± 0.002° |
γ | 107.761 ± 0.002° |
Cell volume | 1853.32 ± 0.09 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.0532 |
Weighted residual factors for all reflections included in the refinement | 0.148 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
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/2237270.html
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