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Information card for entry 4065607
Preview
Coordinates | 4065607.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H31 I N2 O5 P2 Pd |
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Calculated formula | C28 H31 I N2 O5 P2 Pd |
SMILES | I[Pd]12[P@]3(Oc4c2c(O[P@@]21OC[C@H]1N2c2c(C1)cccc2)ccc4)OC[C@H]1N3c2c(C1)cccc2.O(CC)CC |
Title of publication | Chiral Amino Alcohol Derived Bis-phosphoramidite Pincer Palladium Complexes and Their Applications in Asymmetric Allylation of Aldimines |
Authors of publication | Li, Jie; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard; Klein Gebbink, Robertus J. M. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 6 |
Pages of publication | 1379 |
a | 10.3714 ± 0.0003 Å |
b | 11.8544 ± 0.0002 Å |
c | 13.054 ± 0.0003 Å |
α | 89.198 ± 0.001° |
β | 84.462 ± 0.002° |
γ | 68.804 ± 0.001° |
Cell volume | 1489.01 ± 0.06 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0319 |
Residual factor for significantly intense reflections | 0.0298 |
Weighted residual factors for significantly intense reflections | 0.0768 |
Weighted residual factors for all reflections included in the refinement | 0.0786 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
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/4065607.html
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