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Information card for entry 4069352
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Coordinates | 4069352.cif |
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Original paper (by DOI) | HTML |
Common name | [Ru(H)(κ^3^-SC~4~H~5~N~2~)(PPh~3~)~3~] |
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Chemical name | (1,3-dihydro-1-methyl-2-thio-imidazole-3-ide)-hydride- tris(triphenylphosphine)-ruthenium (II) |
Formula | C58 H51 N2 P3 Ru S |
Calculated formula | C58 H51 N2 P3 Ru S |
Title of publication | Reactivity of the Ruthenium Hydride Complex [Ru{κ3-H,S,S-HB(mt)3}H(PPh3)2] (HB(mt)3= hydrotris(methimazolyl)borate): Catalytic Dimerization of 1-Alkynes and Proton Transfer Reactions |
Authors of publication | Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 9 |
Pages of publication | 2787 |
a | 11.8849 ± 0.0008 Å |
b | 33.952 ± 0.002 Å |
c | 12.1312 ± 0.0009 Å |
α | 90° |
β | 92.019 ± 0.002° |
γ | 90° |
Cell volume | 4892.1 ± 0.6 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 | 0.0735 |
Residual factor for significantly intense reflections | 0.0506 |
Weighted residual factors for significantly intense reflections | 0.1087 |
Weighted residual factors for all reflections included in the refinement | 0.1188 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4069352.html
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