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Dimethyltin(IV) Coordination Polymers Featuring the Versatile Ligand of 2,2′-Bipyrimidine: A Multi-NMR, Hirshfeld Surface Analysis Study and Thermal Properties

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Abstract

Dimethyltin(IV) complex SnMe2(NCS)2 form two coordination polymers when react with the tetradentate 2,2′-bipyrimidine (bpym) ligand. The reaction of SnMe2(NCS)2 with 2,2′-bipyrimidine in a mole ratio of Sn:bpym/2:1 resulted in the formation of [SnMe2(NCS)2(bpym)]·SnMe2(NCS)2 (1) while the reaction of SnMe2(NCS)2 with bpym in a mole ratio of Sn:bpym/1:1 affords [SnMe2(NCS)2(H2O)(bpym)]·bpym (2). The resulting complexes have been characterized using elemental analysis, IR and multinuclear NMR (1H, 13C, 119Sn) spectroscopy. NMR data suggest the formation of [SnMe2(NCS)2-µ-bpym-SnMe2(NCS)2] (3) and [SnMe2(NCS)2(H2O)2]·2bpym (4) in solution for 1 and 2, respectively. The X-ray crystal structure of complex [SnMe2(NCS)2(bpym)]·SnMe2(NCS)2 (1) reveals that the geometry around tin atom in [SnMe2(NCS)2(bpym)] is highly distorted octahedral with a trans-[SnMe2] configuration whereas the geometry around tin atom in SnMe2(NCS)2 is distorted square pyramid due to the strong interaction of bridging NCS− with Sn to form 1D-coordination polymer. The crystal structure of [SnMe2(NCS)2(H2O)(bpym)]·bpym (2) indicates that tin is coordinated by two methyl and two NCS− ligands and one water molecule forming distorted square pyramid which coordinates to one of the two bpym molecules forming 5 + 2-coordinating polyhedron. The crystal packing of 2 indicates the formation of 1D-hydrogen-bonded polymer from a coordinated water molecule and the nitrogen atoms of uncoordinated bpym ligand. The interactions were quantitatively determined by Hirshfeld surface analysis, and thermal properties of the complexes were also investigated.

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The data that support the findings of this study are available in the supplementary material of this article.

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Acknowledgements

We would like to thank the Research Council of K.N. Toosi University of Technology for financial support.

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Authors and Affiliations

  1. Faculty of Chemistry, K.N. Toosi University of Technology, P.O. Box 16315-1618, 15418, Tehran, Iran

    Badri Z. Momeni & S. Farzad Hosseini

  2. Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950, Wrocław 2, Poland

    Jan Janczak

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  1. Badri Z. Momeni
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Momeni, B.Z., Hosseini, S.F. & Janczak, J. Dimethyltin(IV) Coordination Polymers Featuring the Versatile Ligand of 2,2′-Bipyrimidine: A Multi-NMR, Hirshfeld Surface Analysis Study and Thermal Properties. J Inorg Organomet Polym 32, 455–468 (2022). https://doi.org/10.1007/s10904-021-02093-z

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