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Information card for entry 4071594
Preview
Coordinates | 4071594.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C58 H57 F12 N O3 P4 Ru |
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Calculated formula | C58 H57 F12 N O3 P4 Ru |
SMILES | [Ru]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)(=C=C5c6[n+](c(ccc6)C)CC5CC(=O)OC)[cH]5[cH]4[cH]3[cH]2[cH]15.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].O1CCCC1 |
Title of publication | Reactions of Ruthenium Acetylide and Vinylidene Complexes Containing a 2-Pyridyl Group |
Authors of publication | Chou, Hsien-Hsin; Lin, Ying-Chih; Huang, Shou-Ling; Liu, Yi-Hong; Wang, Yu |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 20 |
Pages of publication | 5212 |
a | 12.0479 ± 0.0002 Å |
b | 15.3359 ± 0.0002 Å |
c | 16.6007 ± 0.0003 Å |
α | 72.371 ± 0.001° |
β | 81.136 ± 0.001° |
γ | 86.12 ± 0.001° |
Cell volume | 2887.56 ± 0.08 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1124 |
Residual factor for significantly intense reflections | 0.0755 |
Weighted residual factors for significantly intense reflections | 0.2058 |
Weighted residual factors for all reflections included in the refinement | 0.2487 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.955 |
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/4071594.html
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Users of the data should acknowledge the original authors of the
structural data.