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Structure and IR, UV spectroscopic behavior of azabicyclo[2.2.2]octane pentachlorophenolate

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Abstract

The structure of C6Cl5O·C7H13NH+ has been determined by X-ray diffraction. The crystals are orthorhombic:Pcab,a=10.706(1),b=11.966(2),c=24.913(5)Å,Z=8. The structure was solved by direct methods, and refined to R=0.042 for 1523 nonzero reflections. The N+-H⋯O hydrogen bond is shortened (2.553(5)Å) and deformed (<NHO=164(4)°, <CON=137.0(3)°). IR and UV spectra indicate the ionic character of the complex and a moderately strong hydrogen bond.

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Majerz, I., Malarski, Z. & Sawka-Dobrowolska, W. Structure and IR, UV spectroscopic behavior of azabicyclo[2.2.2]octane pentachlorophenolate. Journal of Crystallographic and Spectroscopic Research 23, 555–561 (1993). https://doi.org/10.1007/BF01228764

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  • DOI: https://doi.org/10.1007/BF01228764

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