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Information card for entry 4323178
Preview
Coordinates | 4323178.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H42 Cl6 F6 N3 O P3 Ru |
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Calculated formula | C50 H42 Cl6 F6 N3 O P3 Ru |
SMILES | [Ru]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)(Cl)([n]2c(N=[N]1c1ccc(Cl)cc1)cccc2)C#[O].[P](F)(F)(F)(F)(F)[F-].ClCCl.ClCCl |
Title of publication | Isolation and Structure of the First Azo Anion Radical Complexes of Ruthenium |
Authors of publication | Maya Shivakumar; Kausikisankar Pramanik; Prasanta Ghosh; Animesh Chakravorty |
Journal of publication | Inorganic Chemistry |
Year of publication | 1998 |
Journal volume | 37 |
Pages of publication | 5968 - 5969 |
a | 15.041 ± 0.007 Å |
b | 23.986 ± 0.008 Å |
c | 28.94 ± 0.019 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 10441 ± 9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 8 |
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 | 0.1163 |
Residual factor for significantly intense reflections | 0.06 |
Weighted residual factors for all reflections | 0.1803 |
Weighted residual factors for significantly intense reflections | 0.1346 |
Goodness-of-fit parameter for all reflections | 1.067 |
Goodness-of-fit parameter for significantly intense reflections | 1.105 |
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/4323178.html
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