Abstract

The reaction of ligand 5,7-di-hydro-1H,3H-dithieno[3,4-b:3',4'-e]pyrazine (L) with CuI lead to the formation of a three-dimensional coordination polymer, incorporating the well known [Cu x I x ] n staircase motif (x = 4). These polymer [Cu4I4] n chains are linked via the N and S atoms of the ligand to form the three-dimensional coordination polymer poly[(μ4-5,7-di-hydro-1H,3H-dithieno[3,4-b:3',4'-e]pyrazine-κ4 N:N':S:S')tetra-μ3-iodido-tetra-copper], [Cu4I4(C8H8N2S2)] n (I). The asymmetric unit is composed of half a ligand mol-ecule, with the pyrazine ring located about a center of symmetry, and two independent copper(I) atoms and two independent I- ions forming the staircase motif via centers of inversion symmetry. The framework is consolidated by C-H⋯I hydrogen bonds.

Highlights

  • The reaction of ligand 5,7-dihydro-1H,3H-dithieno[3,4-b:30,40-e]pyrazine (L) with CuI lead to the formation of a three-dimensional coordination polymer, incorporating the well known [CuxIx]n staircase motif (x = 4). These polymer [Cu4I4]n chains are linked via the N and S atoms of the ligand to form the threedimensional coordination polymer poly[(4-5,7-dihydro-1H,3H-dithieno[3,4b:30,40-e]pyrazine-4N:N0:S:S0)tetra-3-iodido-tetracopper], [Cu4I4(C8H8N2S2)]n (I)

  • The asymmetric unit is composed of half a ligand molecule, with the pyrazine ring located about a center of symmetry, and two independent copper(I) atoms and two independent IÀ ions forming the staircase motif via centers of inversion symmetry

  • We have recently shown that the reaction of the ligand 5,7-dihydro-1H,3H-dithieno[3,4b:30,40-e]pyrazine (L), with silver(I) nitrate leads to the formation of a two-dimensional coordination polymer, with the silver atom coordinating only to the S atoms of the ligand so forming chains

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Summary

Structure description

We have recently shown that the reaction of the ligand 5,7-dihydro-1H,3H-dithieno[3,4b:30,40-e]pyrazine (L), with silver(I) nitrate leads to the formation of a two-dimensional coordination polymer, with the silver atom coordinating only to the S atoms of the ligand so forming chains. The reaction of L with CuCl2 and CuBr2 lead to the formation of isostructural one-dimensional coordination polymers with the ligand coordinating to the copper atom via the N atoms only (Assoumatine & Stoeckli-Evans, 2020b). Atom S1 deviates by 0.5076 (14) Afrom the mean plane of the four C atoms (C1–C4) This is considerably more than in the silver(I) nitrate two-dimensional coordination polymer or the ligand itself (Assoumatine & Stoeckli-Evans, 2020a). In the former, the S atom deviates from the mean plane of the four C atoms by 0.170 (15) A , and in the latter by only 0.0256 (8) A.

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