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Information card for entry 4111988
Preview
Coordinates | 4111988.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H36 F6 N6 O10 Rh2 S2 |
---|---|
Calculated formula | C40 H36 F6 N6 O10 Rh2 S2 |
SMILES | [Rh]1234([Rh](OC5N(S(=O)(=O)C(F)(F)F)[C@@H]([C@H]([N]4=5)c4ccccc4)c4ccccc4)([O]=C(O2)C)(OC(=[O]3)C)([N]#CC)[N]2=C(O1)N(S(=O)(=O)C(F)(F)F)[C@@H]([C@H]2c1ccccc1)c1ccccc1)[N]#CC |
Title of publication | Catalysis of Enantioselective [2+1]-Cycloaddition Reactions of Ethyl Diazoacetate and Terminal Acetylenes Using Mixed-Ligand Complexes of the Series Rh2(RCO2)n(L*4-n). Stereochemical Heuristics for Ligand Exchange and Catalyst Synthesis |
Authors of publication | Yan Lou; Travis P. Remarchuk; E. J. Corey |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2005 |
Journal volume | 127 |
Pages of publication | 14223 - 14230 |
a | 11.5271 ± 0.0019 Å |
b | 16.631 ± 0.003 Å |
c | 12.189 ± 0.002 Å |
α | 90° |
β | 98.614 ± 0.003° |
γ | 90° |
Cell volume | 2310.4 ± 0.7 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 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 | 0.0457 |
Residual factor for significantly intense reflections | 0.0386 |
Weighted residual factors for significantly intense reflections | 0.0659 |
Weighted residual factors for all reflections included in the refinement | 0.0682 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.912 |
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/4111988.html
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Users of the data should acknowledge the original authors of the
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