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Information card for entry 4069619
Preview
Coordinates | 4069619.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H37 Cl4 N2 O6 P Pd |
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Calculated formula | C36 H37 Cl4 N2 O6 P Pd |
SMILES | [Pd]12(c3ccc4ccccc4c3[C@@H](C)[N]1(C)C)[n]1ccccc1C[C@@H](C(=O)OC)[P]2(c1ccccc1)c1ccccc1.C(Cl)(Cl)Cl.Cl(=O)(=O)(=O)[O-] |
Title of publication | Highly Enantioselective Synthesis of (2-Pyridyl)phosphine Based C-Chiral Unsymmetrical P,N-Ligands Using a Chiral Palladium Complex |
Authors of publication | Liu, Fengli; Pullarkat, Sumod A.; Li, Yongxin; Chen, Shuli; Yuan, Mingjun; Lee, Zhi Yi; Leung, Pak-Hing |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 13 |
Pages of publication | 3941 |
a | 9.7638 ± 0.0003 Å |
b | 9.9971 ± 0.0003 Å |
c | 10.092 ± 0.0003 Å |
α | 84.906 ± 0.001° |
β | 73.042 ± 0.002° |
γ | 86.771 ± 0.001° |
Cell volume | 938.04 ± 0.05 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0376 |
Residual factor for significantly intense reflections | 0.0331 |
Weighted residual factors for significantly intense reflections | 0.0657 |
Weighted residual factors for all reflections included in the refinement | 0.0686 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4069619.html
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