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Information card for entry 4087402
Preview
Coordinates | 4087402.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C47 H44 Cl4 F6 O3 P3 Ru |
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Calculated formula | C47 H44 Cl4 F6 O3 P3 Ru |
SMILES | C(#C[C](c1ccccc1)c1ccccc1)[Ru]1234([cH]5[cH]1[cH]2[c]13cccc[c]451)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](OC)(OC)OC.C(Cl)Cl.[P](F)(F)(F)(F)(F)[F-].ClCCl |
Title of publication | Nucleophilic Additions to Allenylidene Ruthenium Complexes |
Authors of publication | García de la Arada, Isaac; Díez, Josefina; Gamasa, M. Pilar; Lastra, Elena |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 7 |
Pages of publication | 1345 |
a | 10.5041 ± 0.0003 Å |
b | 13.5409 ± 0.0004 Å |
c | 18.8293 ± 0.0006 Å |
α | 102.658 ± 0.003° |
β | 105.091 ± 0.003° |
γ | 105.866 ± 0.003° |
Cell volume | 2362.67 ± 0.15 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 ± 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 | 0.094 |
Residual factor for significantly intense reflections | 0.0895 |
Weighted residual factors for significantly intense reflections | 0.2504 |
Weighted residual factors for all reflections included in the refinement | 0.2557 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
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/4087402.html
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Users of the data should acknowledge the original authors of the
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