Information card for entry 2101428

Structure parameters

• Formula: C7 H16 Cl N O2
• Calculated formula: C7 H16 Cl N O2
• Title of publication: Conformational analysis of acetylcholine and related choline esters
• Authors of publication: Frydenvang, K.; Jensen, B.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 1
• Pages of publication: 184 - 193
• a: 9.89 ± 0.002 Å
• b: 15.324 ± 0.006 Å
• c: 6.302 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 955.1 ± 0.6 ų
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No