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Information card for entry 4069827
Preview
Coordinates | 4069827.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H38 Cl2 N2 Ru S |
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Calculated formula | C38 H38 Cl2 N2 Ru S |
SMILES | [Ru]1(Cl)(Cl)([S](c2ccccc2C=1)c1cc2ccccc2cc1)=C1N(CCN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C |
Title of publication | Photoactivation of Ruthenium Olefin Metathesis Initiators |
Authors of publication | Ben-Asuly, Amos; Aharoni, Anna; Diesendruck, Charles E.; Vidavsky, Yuval; Goldberg, Israel; Straub, Bernd F.; Lemcoff, N. Gabriel |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 16 |
Pages of publication | 4652 |
a | 38.9862 ± 0.0009 Å |
b | 8.5771 ± 0.0003 Å |
c | 28.1811 ± 0.0008 Å |
α | 90° |
β | 125.811 ± 0.0017° |
γ | 90° |
Cell volume | 7642 ± 0.4 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0971 |
Residual factor for significantly intense reflections | 0.0689 |
Weighted residual factors for significantly intense reflections | 0.1598 |
Weighted residual factors for all reflections included in the refinement | 0.1693 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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