Information card for entry 7233542

Structure parameters

• Common name: (+/-) Synephrine L-tarataric acid salt (2:1)
• Formula: C22 H32 N2 O10
• Calculated formula: C22 H32 N2 O10
• Title of publication: Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
• Authors of publication: Dash, Sibananda G.; Thakur, Tejender S.
• Journal of publication: Physical Chemistry Chemical Physics
• Year of publication: 2019
• a: 5.6127 ± 0.0004 Å
• b: 9.3029 ± 0.0007 Å
• c: 11.6456 ± 0.0006 Å
• α: 101.243 ± 0.005°
• β: 91.903 ± 0.005°
• γ: 105.888 ± 0.006°
• Cell volume: 571.19 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0607
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.1227
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No