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Information card for entry 1506132
Preview
Coordinates | 1506132.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H21 N O |
---|---|
Calculated formula | C19 H21 N O |
SMILES | c12c(cccc1)[C@@H]([C@H](C(=O)N2)c1ccccc1)CCCC.c12c(cccc1)[C@H]([C@@H](C(=O)N2)c1ccccc1)CCCC |
Title of publication | Regioselective carbolithiation of o-amino-(E)-stilbenes: cascade route to the quinoline scaffold. |
Authors of publication | Hogan, Anne-Marie L; O'Shea, Donal F |
Journal of publication | Organic letters |
Year of publication | 2006 |
Journal volume | 8 |
Journal issue | 17 |
Pages of publication | 3769 - 3772 |
a | 12.903 ± 0.004 Å |
b | 15.659 ± 0.005 Å |
c | 17.267 ± 0.006 Å |
α | 98.252 ± 0.006° |
β | 103.842 ± 0.006° |
γ | 108.822 ± 0.005° |
Cell volume | 3112.5 ± 1.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.058 |
Residual factor for significantly intense reflections | 0.0454 |
Weighted residual factors for significantly intense reflections | 0.1133 |
Weighted residual factors for all reflections included in the refinement | 0.1208 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
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/1506132.html
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