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Information card for entry 7008072
Preview
Coordinates | 7008072.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H62 Cl10 O6 P2 Pd |
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Calculated formula | C52 H62 Cl10 O6 P2 Pd |
SMILES | ClCCl.ClCCl.[Pd]([P](c1ccc(cc1C)OC)(c1ccc(OC)cc1C)c1ccc(OC)cc1C)([P](c1ccc(cc1C)OC)(c1ccc(OC)cc1C)c1ccc(OC)cc1C)(Cl)Cl.C(Cl)Cl.C(Cl)Cl |
Title of publication | Special effects of ortho-isopropylphenyl groups. Diastereoisomerism in platinum(II) and palladium(II) complexes of helically chiral PAr3 ligands. |
Authors of publication | Baber, R. Angharad; Orpen, A. Guy; Pringle, Paul G.; Wilkinson, Matthew J.; Wingad, Richard L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2005 |
Journal issue | 4 |
Pages of publication | 659 - 667 |
a | 11.035 ± 0.002 Å |
b | 12.02 ± 0.002 Å |
c | 12.441 ± 0.003 Å |
α | 63.49 ± 0.03° |
β | 77.64 ± 0.03° |
γ | 89.59 ± 0.03° |
Cell volume | 1435.1 ± 0.7 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 | 0.0718 |
Residual factor for significantly intense reflections | 0.0582 |
Weighted residual factors for significantly intense reflections | 0.1328 |
Weighted residual factors for all reflections included in the refinement | 0.1383 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.109 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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