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Information card for entry 4069218
Preview
Coordinates | 4069218.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H34 B Cl N6 P2 Ru |
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Calculated formula | C30 H34 B Cl N6 P2 Ru |
SMILES | [Ru]12(Cl)([P](C)(C)C)([P](c3ccccc3)(c3ccccc3)c3ccccc3)[n]3n([BH](n4[n]1ccc4)n1[n]2ccc1)ccc3 |
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 | 12.3342 ± 0.0002 Å |
b | 20.1362 ± 0.0003 Å |
c | 13.1231 ± 0.0002 Å |
α | 90° |
β | 105.61 ± 0.001° |
γ | 90° |
Cell volume | 3139.09 ± 0.09 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0704 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.0781 |
Weighted residual factors for all reflections included in the refinement | 0.0844 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
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/4069218.html
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