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Information card for entry 1550968
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Coordinates | 1550968.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Moris565b (Mingyuan Li) |
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Formula | C79 H64 Cl2 N3 O Pd |
Calculated formula | C79 H64 Cl2 N3 O Pd |
SMILES | [Pd]123(Oc4c([N]1=C1N(C=CN1c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C(c1ccccc1)c1ccccc1)c1c(cc(C)cc1C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)cccc4)C[CH]2=[CH2]3.ClCCl |
Title of publication | Norbornene polymerization and copolymerization with 1-alkenes by neutral palladium complexes bearing aryloxide imidazolin-2-imine ligand |
Authors of publication | Li, Mingyuan; Zhang, Hu; Cai, Zhengguo; Eisen, Moris S. |
Journal of publication | Polymer Chemistry |
Year of publication | 2019 |
Journal volume | 10 |
Journal issue | 21 |
Pages of publication | 2741 |
a | 11.1555 ± 0.0012 Å |
b | 13.2102 ± 0.0014 Å |
c | 21.891 ± 0.002 Å |
α | 75.266 ± 0.002° |
β | 86.56 ± 0.002° |
γ | 88.068 ± 0.002° |
Cell volume | 3113.7 ± 0.6 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 296.15 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 | 0.0908 |
Residual factor for significantly intense reflections | 0.0547 |
Weighted residual factors for significantly intense reflections | 0.1368 |
Weighted residual factors for all reflections included in the refinement | 0.1556 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 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/1550968.html
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Users of the data should acknowledge the original authors of the
structural data.