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Information card for entry 7016224
Preview
Coordinates | 7016224.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H43 F O2 P2 Pd |
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Calculated formula | C28 H43 F O2 P2 Pd |
SMILES | [Pd]12([P](Oc3c2c(O[P]1(C(C)(C)C)C(C)(C)C)ccc3)(C(C)(C)C)C(C)(C)C)c1ccc(F)cc1 |
Title of publication | Synthesis and characterization of fluorophenylpalladium pincer complexes: electronic properties of some pincer ligands evaluated by multinuclear NMR spectroscopy and electrochemical studies. |
Authors of publication | Polukeev, Alexey V.; Kuklin, Sergey A.; Petrovskii, Pavel V.; Peregudova, Svetlana M.; Smol'yakov, Alexander F.; Dolgushin, Fedor M.; Koridze, Avthandil A. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 27 |
Pages of publication | 7201 - 7209 |
a | 8.3067 ± 0.0005 Å |
b | 10.6772 ± 0.0006 Å |
c | 17.3068 ± 0.001 Å |
α | 93.176 ± 0.001° |
β | 99.251 ± 0.001° |
γ | 109.389 ± 0.001° |
Cell volume | 1419.31 ± 0.14 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0419 |
Residual factor for significantly intense reflections | 0.033 |
Weighted residual factors for significantly intense reflections | 0.0678 |
Weighted residual factors for all reflections included in the refinement | 0.0718 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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