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Information card for entry 7030486
Preview
Coordinates | 7030486.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H19 Cl4 Fe N3 Pd |
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Calculated formula | C20 H19 Cl4 Fe N3 Pd |
SMILES | c1cccc2Cn3ccc([c]45[cH]6[cH]7[cH]8[cH]4[Fe]49%10%115678[cH]5[cH]4[cH]9[cH]%10[cH]%115)[n]3[Pd]([n]12)(Cl)Cl.C(Cl)Cl |
Title of publication | Ferrocenylpyrazolyl palladium complexes as catalysts for the polymerisation of 1-heptene and 1-octene to highly branched polyolefins. |
Authors of publication | Obuah, Collins; Munyaneza, Apollinaire; Guzei, Ilia A.; Darkwa, James |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 23 |
Pages of publication | 8940 - 8950 |
a | 36.226 ± 0.005 Å |
b | 8.0372 ± 0.0009 Å |
c | 15.4503 ± 0.0019 Å |
α | 90° |
β | 103.443 ± 0.003° |
γ | 90° |
Cell volume | 4375.2 ± 0.9 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0693 |
Residual factor for significantly intense reflections | 0.0417 |
Weighted residual factors for significantly intense reflections | 0.0835 |
Weighted residual factors for all reflections included in the refinement | 0.0948 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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