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Information card for entry 4105351
Preview
Coordinates | 4105351.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H64 N4 O20 Rh2 |
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Calculated formula | C60 H64 N4 O20 Rh2 |
SMILES | [Rh]1234([Rh]([O]=C(O1)[C@@H](N1C(=O)c5ccccc5C1=O)C(C)C)(OC(=[O]2)[C@@H](N1C(=O)c2ccccc2C1=O)C(C)C)([O]=C(O3)[C@@H](N1C(=O)c2ccccc2C1=O)C(C)C)(OC(=[O]4)[C@@H](N1C(=O)c2ccccc2C1=O)C(C)C)[O]=C(OCC)C)[O]=C(OCC)C |
Title of publication | Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids |
Authors of publication | Vincent N. G. Lindsay; Wei Lin; André B. Charette |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2009 |
Journal volume | 131 |
Pages of publication | 16383 - 16385 |
a | 16.0549 ± 0.0019 Å |
b | 21.667 ± 0.003 Å |
c | 18.052 ± 0.002 Å |
α | 90° |
β | 92.792 ± 0.003° |
γ | 90° |
Cell volume | 6272.1 ± 1.3 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0644 |
Residual factor for significantly intense reflections | 0.051 |
Weighted residual factors for significantly intense reflections | 0.1352 |
Weighted residual factors for all reflections included in the refinement | 0.1432 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4105351.html
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Users of the data should acknowledge the original authors of the
structural data.