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Information card for entry 1555367
Preview
Coordinates | 1555367.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H23 N O7 |
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Calculated formula | C18 H23 N O7 |
SMILES | C1OC2(C[C@H](C(=O)CC2)C[C@@H](N(=O)=O)c2ccc(OC)c(OC)c2)OC1 |
Title of publication | Formal Synthesis of (+)-Lasubine II and (-)-Subcosine II via Organocatalytic Michael Addition of a Ketone to an α-Nitrostyrene. |
Authors of publication | N V G, Moorthy; Dyapa, Rajendar; Pansare, Sunil V. |
Journal of publication | Organic letters |
Year of publication | 2015 |
Journal volume | 17 |
Journal issue | 21 |
Pages of publication | 5312 - 5315 |
a | 10.2093 ± 0.0001 Å |
b | 10.2093 ± 0.0001 Å |
c | 30.4222 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 2746.08 ± 0.05 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 4 |
Space group number | 170 |
Hermann-Mauguin space group symbol | P 65 |
Hall space group symbol | P 65 |
Residual factor for all reflections | 0.0321 |
Residual factor for significantly intense reflections | 0.0314 |
Weighted residual factors for significantly intense reflections | 0.0911 |
Weighted residual factors for all reflections included in the refinement | 0.0929 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1555367.html
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Users of the data should acknowledge the original authors of the
structural data.