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Information card for entry 7155531
Preview
Coordinates | 7155531.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H23 N O2 |
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Calculated formula | C15 H23 N O2 |
SMILES | O=C1N[C@H](C[C@@H](O)C1)C12CC3CC(C1)CC(C3)C2 |
Title of publication | Stereoselective synthesis of novel adamantane derivatives with high potency against rimantadine-resistant influenza A virus strains. |
Authors of publication | Kuznetsov, Nikolai Yu; Tikhov, Rabdan M.; Godovikov, Ivan A.; Medvedev, Michael G.; Lyssenko, Konstantin A.; Burtseva, Elena I.; Kirillova, Elena S.; Bubnov, Yuri N. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2017 |
Journal volume | 15 |
Journal issue | 15 |
Pages of publication | 3152 - 3157 |
a | 8.3872 ± 0.0017 Å |
b | 10.676 ± 0.002 Å |
c | 28.705 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2570.3 ± 0.9 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 4 |
Space group number | 20 |
Hermann-Mauguin space group symbol | C 2 2 21 |
Hall space group symbol | C 2c 2 |
Residual factor for all reflections | 0.1119 |
Residual factor for significantly intense reflections | 0.0784 |
Weighted residual factors for significantly intense reflections | 0.1837 |
Weighted residual factors for all reflections included in the refinement | 0.1994 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
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/7155531.html
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