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Information card for entry 4122403
Preview
Coordinates | 4122403.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H54 N O3 P Pd S |
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Calculated formula | C34 H54 N O3 P Pd S |
SMILES | [Pd]1([P](c2ccccc2S(=O)(=O)O1)([C@H]1[C@@H](CC[C@H](C1)C)C(C)C)[C@H]1[C@H](C(C)C)CC[C@@H](C)C1)([n]1c(cccc1C)C)C |
Title of publication | Quantification of the Steric Influence of Alkylphosphine-Sulfonate Ligands on Polymerization, Leading to High-Molecular-Weight Copolymers of Ethylene and Polar Monomers. |
Authors of publication | Ota, Yusuke; Ito, Shingo; Kuroda, Jun-Ichi; Okumura, Yoshikuni; Nozaki, Kyoko |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 34 |
Pages of publication | 11898 |
a | 9.8649 ± 0.0015 Å |
b | 15.274 ± 0.002 Å |
c | 12.1669 ± 0.0019 Å |
α | 90° |
β | 111.051 ± 0.0017° |
γ | 90° |
Cell volume | 1710.9 ± 0.4 Å3 |
Cell temperature | 93 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 7 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0296 |
Residual factor for significantly intense reflections | 0.0286 |
Weighted residual factors for significantly intense reflections | 0.0553 |
Weighted residual factors for all reflections included in the refinement | 0.056 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4122403.html
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