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Information card for entry 4080919
Preview
Coordinates | 4080919.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H19 Cl F6 N3 O P Ru S |
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Calculated formula | C21 H19 Cl F6 N3 O P Ru S |
SMILES | c1(ccccc1)[S]1Cn2cc(c3ccccc3)n[n]2[Ru]234561([cH]1[cH]6[cH]5[cH]4[cH]3[cH]21)Cl.[P](F)(F)(F)(F)(F)[F-].O |
Title of publication | Half-Sandwich Ruthenium(II) Complexes of Click Generated 1,2,3-Triazole Based Organosulfur/-selenium Ligands: Structural and Donor Site Dependent Catalytic Oxidation and Transfer Hydrogenation Aspects |
Authors of publication | Saleem, Fariha; Rao, Gyandshwar Kumar; Kumar, Arun; Mukherjee, Goutam; Singh, Ajai K. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 13 |
Pages of publication | 3595 |
a | 10.875 ± 0.003 Å |
b | 13.808 ± 0.004 Å |
c | 17.351 ± 0.005 Å |
α | 90° |
β | 101.785 ± 0.005° |
γ | 90° |
Cell volume | 2550.5 ± 1.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 9 |
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 | 0.035 |
Residual factor for significantly intense reflections | 0.032 |
Weighted residual factors for significantly intense reflections | 0.0881 |
Weighted residual factors for all reflections included in the refinement | 0.0899 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4080919.html
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