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Information card for entry 4063485
Preview
Coordinates | 4063485.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C55 H52 Cl8 O5 P2 Pd |
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Calculated formula | C55 H52 Cl8 O5 P2 Pd |
SMILES | [Pd]1(Cl)(Cl)[P]2(OC([C@@H]3OC(O[C@H]3C(O2)(c2ccccc2)c2ccccc2)(C)C)(c2ccccc2)c2ccccc2)Oc2c([P]1(c1ccccc1)c1ccccc1)cccc2C(C)(C)C.ClC(Cl)Cl.ClC(Cl)Cl |
Title of publication | Asymmetric Hydroformylation Using Taddol-Based Chiral Phosphine−Phosphite Ligands |
Authors of publication | Robert, Tobias; Abiri, Zohar; Wassenaar, Jeroen; Sandee, Albertus J.; Romanski, Steffen; Neudörfl, Jörg-Martin; Schmalz, Hans-Günther; Reek, Joost N. H. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 2 |
Pages of publication | 478 - 483 |
a | 11.7707 ± 0.001 Å |
b | 14.8558 ± 0.001 Å |
c | 15.7168 ± 0.001 Å |
α | 90° |
β | 99.1439 ± 0.001° |
γ | 90° |
Cell volume | 2713.4 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.071 |
Residual factor for significantly intense reflections | 0.0455 |
Weighted residual factors for significantly intense reflections | 0.0857 |
Weighted residual factors for all reflections included in the refinement | 0.103 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.969 |
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/4063485.html
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Users of the data should acknowledge the original authors of the
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