Information card for entry 2001747

Structure parameters

• Formula: C24 H45 N O4
• Calculated formula: C24 H45 N O4
• Title of publication: Structures of tetradecyltrimethylammonium salicylate monohydrate (1) and hexadecyltrimethylammonium salicylate monohydrate (2)
• Authors of publication: Koh, L. L.; Xu, Y.; Gan, L. M.; Chew, C. H.; Lee, K. C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 1032 - 1035
• a: 7.059 ± 0.001 Å
• b: 7.436 ± 0.002 Å
• c: 24.572 ± 0.007 Å
• α: 86.25 ± 0.02°
• β: 88.85 ± 0.02°
• γ: 88.62 ± 0.02°
• Cell volume: 1286.4 ± 0.5 ų
• Cell temperature: 298 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 significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.061
• Goodness-of-fit parameter for significantly intense reflections: 0.77
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No