Information card for entry 7053765

Structure parameters

• Common name: Ampheatmine sulphate
• Formula: C18 H28 N2 O4 S
• Calculated formula: C18 H28 N2 O4 S
• Title of publication: The crystal structure and evidence of the phase transition in d-amphetamine sulfate, as studied by X-ray crystallography, DSC and NMR spectroscopy
• Authors of publication: Pogorzelec-Glaser, Katarzyna; Kaszyńska, Joanna; Rachocki, Adam; Tritt-Goc, Jadwiga; Piślewski, Narcyz; Pietraszko, Adam
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 9
• Pages of publication: 1894
• a: 10.102 ± 0.0019 Å
• b: 6.318 ± 0.0012 Å
• c: 16.512 ± 0.006 Å
• α: 90 ± 0.02°
• β: 92.07 ± 0.02°
• γ: 90 ± 0.016°
• Cell volume: 1053.2 ± 0.5 ų
• Cell temperature: 336 ± 2 K
• Ambient diffraction temperature: 336 ± 2 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: 0.1358
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0856
• Weighted residual factors for all reflections included in the refinement: 0.0982
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No