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Single-Crystal Structure Analysis of Three Novel Iron(II) Coordination Polymers with Bridging 1,3,5-Tris((1H-1,2,4-triazol-1-yl)methyl)benzene

Limon, Aysenur;Jordan, Dustin N.;Strothmann, Till;Cuignet, Laure P.;Janiak, Christoph;et.al.
(2023) Crystals — Vol. 13, n° 11, p. 1574 (2023)

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Authors
  • Limon, Aysenur
    Author
  • Jordan, Dustin N.
    Author
  • Strothmann, Till
    Author
  • Cuignet, Laure P.
    Author
  • Garcia, Yannorcid-logoUCLouvain
    Author
  • Janiak, Christophorcid-logo
    Author
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Abstract
Three novel iron(II) coordination polymers, namely [Fe(H2O)2(ttmb)2](ClO4)2·4H2O (1), [Fe(H2O)2(ttmb)2](BF4)2·4H2O (2) and [Fe(NCS)2(ttmb)2] (3), were synthesized with the linker 1,3,5-tris((1H-1,2,4-triazol-1-yl)methyl)benzene (ttmb). The single-crystal structures show that all three compounds form a double-chain structure with the adjacent iron atoms being bridged by two ttmb linkers. The iron(II) ions are octahedrally surrounded by four N4 donor atoms from the 1,2,4-triazol-1-yl groups of four different ttmb linkers which form an equatorial plane and two trans-coordinated aqua ligands in 1 and 2 or isothiocyanato ligands in 3 in the axial positions. In view of the neutral bridging ttmb linker, there is a non-coordinated counter-anion in 1 and 2 (ClO4 and BF4, respectively), and a coordinated NCS anion in 3. Compounds 1 and 2 are isostructural. Interestingly, the ttmb linker only utilizes two of its three potentially coordinating triazole groups. All iron(II) coordination networks are colorless or have a light-yellow color, being indicative of the high-spin state.
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Citations

Limon, A., Jordan, D. N., Strothmann, T., Cuignet, L. P., Garcia, Y., & Janiak, C. (2023). Single-Crystal Structure Analysis of Three Novel Iron(II) Coordination Polymers with Bridging 1,3,5-Tris((1H-1,2,4-triazol-1-yl)methyl)benzene. Crystals, 13(11), 1574. https://doi.org/10.3390/cryst13111574 (Original work published 2023)