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Information card for entry 7037780
Preview
Coordinates | 7037780.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H29 F3 N4 O4 Pd S |
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Calculated formula | C25 H29 F3 N4 O4 Pd S |
SMILES | [Pd]12([n]3c(c4[n]2cccc4)cccc3)[N](=C(OCc2c1cccc2)NC(C)C)C(C)C.S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Reactivity towards nitriles, cyanamides, and carbodiimides of palladium complexes derived from benzyl alcohol. Synthesis of a mixed Pd2Ag complex. |
Authors of publication | Fernández-Rodríguez, María-José; Martínez-Viviente, Eloísa; Vicente, José; Jones, Peter G. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 45 |
Journal issue | 2 |
Pages of publication | 820 - 830 |
a | 7.972 ± 0.0002 Å |
b | 17.9802 ± 0.0005 Å |
c | 36.9522 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5296.7 ± 0.2 Å3 |
Cell temperature | 103 ± 2 K |
Ambient diffraction temperature | 103 ± 2 K |
Number of distinct elements | 7 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.042 |
Residual factor for significantly intense reflections | 0.0254 |
Weighted residual factors for significantly intense reflections | 0.0599 |
Weighted residual factors for all reflections included in the refinement | 0.0619 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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