Information card for entry 2010268

Structure parameters

• Formula: C14 H22 Br N O3
• Calculated formula: C14 H22 Br N O3
• Title of publication: Two dimethylmorpholinium bromides
• Authors of publication: Garcia, J.G.; Fronzek, F.R.; Gandour, R.D.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 12
• Pages of publication: 2022 - 2025
• a: 11.341 ± 0.004 Å
• b: 15.692 ± 0.006 Å
• c: 8.479 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1508.9 ± 0.9 ų
• Cell temperature: 295 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.0468
• Goodness-of-fit parameter for significantly intense reflections: 2.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No