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Information card for entry 7225659
Preview
| Coordinates | 7225659.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H24 N2 |
|---|---|
| Calculated formula | C32 H24 N2 |
| SMILES | c1cc(c2ccccc2)c2c(c(C)cc(c2)c2cc(C)c3c(c2)c(c2ccccc2)ccn3)n1 |
| Title of publication | A Concise Synthesis of Quinolinium, and Biquinolinium Salts and Biquinolines from Benzylic Azides and Alkenes Promoted by Copper(II) Species |
| Authors of publication | Chen, Wei-Chen; Parthasarathy, Gandeepan; Tsai, Chia-Hung; Luo, Ching-Zong; Rajamalli, Pachaiyappan; Cheng, Chien Hong |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 7.917 ± 0.006 Å |
| b | 22.675 ± 0.014 Å |
| c | 25.49 ± 0.02 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4576 ± 6 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.3434 |
| Residual factor for significantly intense reflections | 0.0946 |
| Weighted residual factors for significantly intense reflections | 0.1475 |
| Weighted residual factors for all reflections included in the refinement | 0.2222 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.915 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183903 (current) | 2016-06-24 | cif/ Adding structures of 7225658, 7225659, 7225660 via cif-deposit CGI script. |
7225659.cif |
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Users of the data should acknowledge the original authors of the
structural data.