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Information card for entry 1508733
Preview
Coordinates | 1508733.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H25 N3 O3 |
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Calculated formula | C26 H25 N3 O3 |
SMILES | O1C[C@@H]2N(O[C@@H]3CON(CC3=C2CN1c1ccccc1)c1ccccc1)c1ccccc1.O1C[C@H]2N(O[C@H]3CON(CC3=C2CN1c1ccccc1)c1ccccc1)c1ccccc1 |
Title of publication | Nitroso-dienophile additions to dendralenes: a short synthesis of branched aminosugars. |
Authors of publication | Wang, Ruomeng; Bojase, Gomotsang; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. |
Journal of publication | Organic letters |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 22 |
Pages of publication | 5652 - 5655 |
a | 15.6734 ± 0.0004 Å |
b | 6.13 ± 0.0001 Å |
c | 22.7367 ± 0.0005 Å |
α | 90° |
β | 97.0025 ± 0.001° |
γ | 90° |
Cell volume | 2168.2 ± 0.08 Å3 |
Cell temperature | 200 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0521 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for all reflections | 0.0682 |
Weighted residual factors for significantly intense reflections | 0.0639 |
Weighted residual factors for all reflections included in the refinement | 0.0682 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.8192 |
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/1508733.html
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Users of the data should acknowledge the original authors of the
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