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Information card for entry 7026527
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Coordinates | 7026527.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | trans-Tetrachlorobis(dimethylphenylphosphine) tungsten(IV) |
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Formula | C16 H22 Cl4 P2 W |
Calculated formula | C16 H22 Cl4 P2 W |
SMILES | [W](Cl)([P](c1ccccc1)(C)C)([P](c1ccccc1)(C)C)(Cl)(Cl)Cl |
Title of publication | A tungsten-mediated closed cycle of reactivity for the reduction of CO(2) to CO. |
Authors of publication | Jayarathne, Upul; Chandrasekaran, Perumalreddy; Jacobsen, Heiko; Mague, Joel T.; Donahue, James P. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 40 |
Pages of publication | 9662 - 9671 |
a | 9.644 ± 0.001 Å |
b | 13.781 ± 0.002 Å |
c | 8.203 ± 0.001 Å |
α | 90° |
β | 106.744 ± 0.002° |
γ | 90° |
Cell volume | 1044 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0178 |
Residual factor for significantly intense reflections | 0.0146 |
Weighted residual factors for significantly intense reflections | 0.0336 |
Weighted residual factors for all reflections included in the refinement | 0.0351 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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