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Information card for entry 4063884
Preview
Coordinates | 4063884.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51 H36 Cl4 N2 P2 Pd2 S4 |
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Calculated formula | C51 H36 Cl4 N2 P2 Pd2 S4 |
Title of publication | Hybrid Thiophosphoryl‒Benzothiazole Palladium SCN-Pincer Complexes: Synthesis and Effect of Structure Modifications on Catalytic Performance in the Suzuki Cross-Coupling |
Authors of publication | Kozlov, Vladimir A.; Aleksanyan, Diana V.; Nelyubina, Yulia V.; Lyssenko, Konstantin A.; Petrovskii, Pavel V.; Vasil’ev, Andrei A.; Odinets, Irina L. |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 11 |
Pages of publication | 2920 |
a | 9.6828 ± 0.0006 Å |
b | 11.1434 ± 0.0006 Å |
c | 12.3807 ± 0.0007 Å |
α | 71.529 ± 0.001° |
β | 82.375 ± 0.0011° |
γ | 69.198 ± 0.001° |
Cell volume | 1184.15 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0329 |
Residual factor for significantly intense reflections | 0.0277 |
Weighted residual factors for significantly intense reflections | 0.066 |
Weighted residual factors for all reflections included in the refinement | 0.0678 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4063884.html
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