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Information card for entry 4340181
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Coordinates | 4340181.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | trans-Bis(O-ethyldithiocarbonato)bis(triphenylphosphine)ruthenium(III) Hexafluorophosphate |
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Formula | C42 H40 F6 O2 P3 Ru S4 |
Calculated formula | C42 H40 F6 O2 P3 Ru S4 |
SMILES | [Ru]12([S]=C(S1)OCC)([S]=C(S2)OCC)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Syntheses, structural determinations of [Ru(ROCS2)2(PPh3)2](+/0) pairs, and kinetic analyses of thermal reactions involving transient trans-[Ru(iPrOCS2)2(PPh3)2] species (ROCS2(-) = ethyl- or isopropyldithiocarbonate and PPh3 = triphenylphosphine). |
Authors of publication | Noda, Kyoko; Ohuchi, Yuko; Hashimoto, Akira; Fujiki, Masayuki; Itoh, Sumitaka; Iwatsuki, Satoshi; Noda, Toshiaki; Suzuki, Takayoshi; Kashiwabara, Kazuo; Takagi, Hideo D. |
Journal of publication | Inorganic chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 3 |
Pages of publication | 1349 - 1355 |
a | 18.622 ± 0.004 Å |
b | 21.445 ± 0.006 Å |
c | 11.089 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4428 ± 3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 7 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1964 |
Residual factor for significantly intense reflections | 0.043 |
Weighted residual factors for significantly intense reflections | 0.0932 |
Weighted residual factors for all reflections included in the refinement | 0.1232 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.973 |
Diffraction radiation wavelength | 0.71069 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/4340181.html
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