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Di-n-butyl­ammonium 2-[(3,5-di-tert-butyl-4-hy­droxy­benz­yl)sulfan­yl]benzoate

The title salt, C(8)H(20)N(+)·C(22)H(27)O(3)S(−), is a proton-transfer compound derived from the recently reported parent carb­oxy­lic acid [Alhadi et al. (2010). Acta Cryst. E66, o1787] by the addition of a second equivalent of di-n-butyl­amine, yielding the di-n-butyl­ammonium carboxyl­ate salt. T...

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Detalles Bibliográficos
Autores principales: Alhadi, Abeer A., Khaledi, Hamid, Mohd Ali, Hapipah, Olmstead, Marilyn M.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007956/
https://www.ncbi.nlm.nih.gov/pubmed/21588774
http://dx.doi.org/10.1107/S1600536810033921
Descripción
Sumario:The title salt, C(8)H(20)N(+)·C(22)H(27)O(3)S(−), is a proton-transfer compound derived from the recently reported parent carb­oxy­lic acid [Alhadi et al. (2010). Acta Cryst. E66, o1787] by the addition of a second equivalent of di-n-butyl­amine, yielding the di-n-butyl­ammonium carboxyl­ate salt. The structure of the carboxyl­ate anion resembles that of the parent carb­oxy­lic acid. The main difference lies in the position of the H atom in the 4-hy­droxy group. In the anion the O—H bond is perpendicular, rather than parallel, to the benzyl ring. This position appears to facilitate hydrogen bonding to an O atom of the carboxyl­ate group of a symmetry-related anion. In addition, there are three N—H⋯O hydrogen bonds. In contrast, the neutral species hydrogen bonds via a carboxylic acid dimer. The dihedral angle between the benzene rings in the anion is 79.19 (7)°.