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Information card for entry 4069215
Preview
Coordinates | 4069215.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H42 Cl N3 P2 Ru |
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Calculated formula | C34 H42 Cl N3 P2 Ru |
SMILES | [Ru]1234(Cl)([P]56CN7CN(C5)CN(C6)C7)([P](c5ccccc5)(c5ccccc5)c5ccccc5)[c]5([c]1([c]4([c]3([c]25C)C)C)C)C |
Title of publication | Atom Transfer Radical Addition Reactions of CCl4, CHCl3, andp-Tosyl Chloride Catalyzed by Cp′Ru(PPh3)(PR3)Cl Complexes |
Authors of publication | Nair, Radhika P.; Kim, Tae Ho; Frost, Brian J. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 16 |
Pages of publication | 4681 |
a | 11.6045 ± 0.0002 Å |
b | 14.8894 ± 0.0003 Å |
c | 18.4456 ± 0.0004 Å |
α | 90° |
β | 102.029 ± 0.001° |
γ | 90° |
Cell volume | 3117.12 ± 0.11 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0522 |
Residual factor for significantly intense reflections | 0.0368 |
Weighted residual factors for significantly intense reflections | 0.0758 |
Weighted residual factors for all reflections included in the refinement | 0.0806 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
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/4069215.html
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