Information card for entry 4115224

Structure parameters

• Formula: C19 H23 Br N O4
• Calculated formula: C19 H19 Br N O4
• Title of publication: Synthesis of (-)-Morphine
• Authors of publication: Douglass F. Taber; Timothy D. Neubert; Arnold L. Rheingold
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 12416 - 12417
• a: 14.771 ± 0.003 Å
• b: 5.0353 ± 0.0008 Å
• c: 26.11 ± 0.004 Å
• α: 90°
• β: 98.8 ± 0.005°
• γ: 90°
• Cell volume: 1919.1 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.1298
• Weighted residual factors for all reflections included in the refinement: 0.1357
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No