Information card for entry 2236719

Structure parameters

• Chemical name: Bis(dicyclohexylaminium) 2-carboxymethyl-2-hydroxysuccinate ethanol monosolvate
• Formula: C32 H60 N2 O8
• Calculated formula: C32 H60 N2 O8
• Title of publication: Bis(dicyclohexylaminium) 2-carboxymethyl-2-hydroxysuccinate ethanol monosolvate
• Authors of publication: Foroughian, Mahsa; Notash, Behrouz; Shafiee, Abbas; Aghabozorg, Hossein; Foroumadi, Alireza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 9
• Pages of publication: o2792 - o2793
• a: 10.054 ± 0.002 Å
• b: 12.329 ± 0.003 Å
• c: 13.908 ± 0.003 Å
• α: 99.77 ± 0.03°
• β: 92.17 ± 0.03°
• γ: 95.98 ± 0.03°
• Cell volume: 1687 ± 0.7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0889
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1257
• Weighted residual factors for all reflections included in the refinement: 0.1362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes