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Information card for entry 4343264
Preview
Coordinates | 4343264.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H61 N O P2 Ru |
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Calculated formula | C33 H61 N O P2 Ru |
SMILES | C(#[O])[RuH2]1([N](=C2C(CCC2)[P]1(C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)[P](C(C)C)(C(C)C)C(C)C |
Title of publication | Ruthenium Complexes Stabilized by Bidentate Enamido-Phosphine Ligands: Aspects of Cooperative H2 Activation. |
Authors of publication | Wambach, Truman C.; Fryzuk, Michael D. |
Journal of publication | Inorganic chemistry |
Year of publication | 2015 |
Journal volume | 54 |
Journal issue | 12 |
Pages of publication | 5888 - 5896 |
a | 21.5581 ± 0.0008 Å |
b | 9.707 ± 0.0004 Å |
c | 33.0071 ± 0.0012 Å |
α | 90° |
β | 90.028 ± 0.002° |
γ | 90° |
Cell volume | 6907.2 ± 0.5 Å3 |
Cell temperature | 90.15 K |
Ambient diffraction temperature | 90.15 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0846 |
Residual factor for significantly intense reflections | 0.0566 |
Weighted residual factors for significantly intense reflections | 0.1253 |
Weighted residual factors for all reflections included in the refinement | 0.1359 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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