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Information card for entry 2007259
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| Coordinates | 2007259.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | 1-phenyl-1,2,3,4-tetrahydroisoquinolinine monohydrochloride |
|---|---|
| Formula | C15 H16 Cl N |
| Calculated formula | C15 H16 Cl N |
| Title of publication | Absolute Configuration of (+)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline Hydrochloride |
| Authors of publication | Nakahara, Hideaki; Takeuchi, Makoto; Naito, Ryo; Kurihara, Hiroyuki; Nagano, Noriaki; Isomura, Yasuo; Mase, Toshiyasu |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 5 |
| Pages of publication | 651 - 653 |
| a | 5.264 ± 0.003 Å |
| b | 10.084 ± 0.004 Å |
| c | 24.758 ± 0.003 Å |
| α | 90° |
| β | 93.02 ± 0.04° |
| γ | 90° |
| Cell volume | 1312.4 ± 0.9 Å3 |
| Cell temperature | 298.2 K |
| Ambient diffraction temperature | 298.2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for significantly intense reflections | 0.059 |
| Weighted residual factors for significantly intense reflections | 0.077 |
| Goodness-of-fit parameter for significantly intense reflections | 1.16 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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