Abstract
A protonated diaza-18-crown-6 copper(II) chloride complex was crystallized from a mixture of YCl3, BaCl2, and Cu(C2H3O2)2 in 3:1 CH3OH/CH3CN. [H2(diaza-18-crown-6)][CuC4]·H2O crystallizes_in the centric space group, P1 with: a = 7.429(2) Å, b = 10.099(3) Å, c = 14.779(9) Å, α = 83.76(5)°, β = 81.70(3)°, γ = 75.59(3)°, and Dcalc = 1.53 g/cm3 for Z = 2. The [CuC4]-2 anion is a distorted tetrahedron and is hydrogen-bonded to two unique diazacrown molecules. The bonding results in zig-zag contacts that form a polymeric network diagonally oriented in the bc plane. One of the two unique azacrown molecules maintains a slightly distorted D3d conformation stabilized by hydrogen bonding from a disordered water molecule and to the [CuC4]-2 anion. The hydrogen bonding of the disordered water molecule bridges one form of the protonated macrocycle and forms polymeric chains along the a direction. The other unique azacrown molecule adopts a distorted C2 configuration and has no interactions with the water molecule.
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Nuñez, L., Rogers, R.D. Synthesis and structural characterization of [H2(diaza-18-crown-6)][CuCI4]·H2O. J Chem Crystallogr 27, 5–10 (1997). https://doi.org/10.1007/BF03543081
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DOI: https://doi.org/10.1007/BF03543081