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Information card for entry 7048597
Preview
Coordinates | 7048597.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H49 Cl2 F6 N3 O6 P2 Pd S2 |
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Calculated formula | C52 H49 Cl2 F6 N3 O6 P2 Pd S2 |
Title of publication | Palladium(ii) pincer complexes of a C,C,C-NHC, diphosphonium bis(ylide) ligand. |
Authors of publication | Taakili, Rachid; Lepetit, Christine; Duhayon, Carine; Valyaev, Dmitry A.; Lugan, Noël; Canac, Yves |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 5 |
Pages of publication | 1709 - 1721 |
a | 25.8085 ± 0.001 Å |
b | 13.8014 ± 0.0006 Å |
c | 18.8584 ± 0.0014 Å |
α | 90° |
β | 126.545 ± 0.001° |
γ | 90° |
Cell volume | 5396.6 ± 0.5 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 9 |
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 | 0.0354 |
Residual factor for significantly intense reflections | 0.0315 |
Weighted residual factors for significantly intense reflections | 0.0756 |
Weighted residual factors for all reflections included in the refinement | 0.0786 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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