Information card for entry 2004836

Structure parameters

• Formula: C16 H38 Cl N O4
• Calculated formula: C16 H38 Cl N O4
• Title of publication: <i>cis</i>-8,10-Di-<i>n</i>-propyllobelidiol Hydrochloride Dihydrate
• Authors of publication: Miguel, O. G.; Pizzolatti, M. G.; Yunes, R. A.; Vencato, I.; Calixto, J. B.; Santos, A. R. S.; Contin, A.; Moreira, E. A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 5
• Pages of publication: 1223 - 1225
• a: 8.752 ± 0.002 Å
• b: 27.084 ± 0.005 Å
• c: 17.973 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4260.3 ± 1.3 ų
• Cell temperature: 295 K
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0609
• Weighted residual factors for significantly intense reflections: 0.067
• Goodness-of-fit parameter for significantly intense reflections: 4.45
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No