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Information card for entry 1503294
Preview
Coordinates | 1503294.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H22 N2 |
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Calculated formula | C27 H22 N2 |
SMILES | N(c1c(cccc1/C=C/c1ccccc1)/C=C/c1ccccc1)c1ncccc1 |
Title of publication | Rh(III)-catalyzed oxidative coupling of N-aryl-2-aminopyridine with alkynes and alkenes. |
Authors of publication | Chen, Jinlei; Song, Guoyong; Pan, Cheng-Ling; Li, Xingwei |
Journal of publication | Organic letters |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 23 |
Pages of publication | 5426 - 5429 |
a | 9.6691 ± 0.0011 Å |
b | 12.2798 ± 0.0013 Å |
c | 17.5194 ± 0.0019 Å |
α | 86.733 ± 0.002° |
β | 79.629 ± 0.002° |
γ | 81.639 ± 0.002° |
Cell volume | 2023.4 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0953 |
Residual factor for significantly intense reflections | 0.0478 |
Weighted residual factors for significantly intense reflections | 0.1046 |
Weighted residual factors for all reflections included in the refinement | 0.1283 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
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/1503294.html
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