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Information card for entry 4021906
Preview
Coordinates | 4021906.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H42 Cr O6 Si |
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Calculated formula | C37 H42 Cr O6 Si |
SMILES | [Cr]12345([c]6(C7=C([Si](C(C)C)(C(C)C)C(C)C)C(=O)[C@@H]([C@]7(OC)c7ccc(OC)cc7)c7ccccc7)[cH]1[cH]2[cH]3[cH]4[cH]56)(C#[O])(C#[O])C#[O].[Cr]12345([c]6(C7=C([Si](C(C)C)(C(C)C)C(C)C)C(=O)[C@H]([C@@]7(OC)c7ccc(OC)cc7)c7ccccc7)[cH]1[cH]2[cH]3[cH]4[cH]56)(C#[O])(C#[O])C#[O] |
Title of publication | Stereoselective [4 + 1] Annulation Reactions with Silyl Vinylketenes Derived from Fischer Carbene Complexes |
Authors of publication | William H. Moser; Laura A. Feltes; Liangdong Sun; Matthew W. Giese; Ryan W. Farrell |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2006 |
Journal volume | 71 |
Pages of publication | 6542 - 6546 |
a | 17.5783 ± 0.0016 Å |
b | 18.3011 ± 0.0018 Å |
c | 21.379 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6877.5 ± 1.2 Å3 |
Cell temperature | 83 ± 3 K |
Ambient diffraction temperature | 83 ± 3 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0594 |
Residual factor for significantly intense reflections | 0.0448 |
Weighted residual factors for significantly intense reflections | 0.109 |
Weighted residual factors for all reflections included in the refinement | 0.1189 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
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/4021906.html
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Users of the data should acknowledge the original authors of the
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