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Information card for entry 4025518
Preview
Coordinates | 4025518.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H25 N3 O3 Si |
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Calculated formula | C22 H25 N3 O3 Si |
SMILES | [Si](c1ccccc1)([C@H]1[C@@H]2N3N(C(=O)N(c4ccccc4)C3=O)[C@H]1[C@H](CC2)O)(C)C.[Si](c1ccccc1)([C@@H]1[C@H]2N3N(C(=O)N(c4ccccc4)C3=O)[C@@H]1[C@@H](CC2)O)(C)C |
Title of publication | On the [3 + 2] Annulation of Cyclic Allylsilanes with N-Phenyltriazolinedione: An Enantio- and Diastereoselective Synthesis of cis-1,3-Diaminocyclitols |
Authors of publication | Raudra T. Dey; Tarun K. Sarkar |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2010 |
Journal volume | 75 |
Pages of publication | 4521 - 4529 |
a | 6.984 ± 0.005 Å |
b | 28.198 ± 0.005 Å |
c | 10.424 ± 0.005 Å |
α | 90 ± 0.005° |
β | 92.444 ± 0.005° |
γ | 90 ± 0.005° |
Cell volume | 2051 ± 1.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.2088 |
Residual factor for significantly intense reflections | 0.1092 |
Weighted residual factors for significantly intense reflections | 0.2936 |
Weighted residual factors for all reflections included in the refinement | 0.344 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
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/4025518.html
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