Information card for entry 2007259

Structure parameters

• 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 ų
• 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