Division of Functional Materials Chemistry
State Scientific Institution “Institute for Single Crystals”
of National Academy of Sciences of Ukraine

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Selected publications

  1. Omelchenko I V., Shishkin O V., Gorb L, et al. Properties, aromaticity, and substituents effects in poly nitro- and amino-substituted benzenes.// Structural Chemistry, 2012, v.23, 1585–1597.

  2. Shishkin O V, Dopieralski P, Omelchenko I V, et al. Entropy versus aromaticity in the conformational dynamics of aromatic rings.// Journal of Molecular Modeling, 2013, v.19, 4073–4077

  3. A.V.Luzanov, Semi-canonical MOs in the varied open shell method and related approaches. // Journal of Structural Chemistry, 2014, v.55, No3, p.389-397.

  4. O.V.Shishkin, R.I.Zubatyuk, A.V.Maleev, R.Boese, Investigation of topology of intermolecular interactions in the benzene-acetylene co-crystal by different theoretical methods. // Structural Chemistry, 2014, v.25, No5, p.1547-1552.

  5. S.V.Shishkina, R.I.Zubatyuk, L.I.Kucherenko, N.V.Parnyuk, I.A.Mazur, G.V.Georgievskii, O.V.Shishkin, Anion-pi-system interactions in crystals of 4-amino-1-(ОІ-phenylethyl)-1,2,4-triazolium bromide. // Russian Chemical Bulletin, 2014, v.62, No8, p.1900-1906.

  6. O.V.Shishkin, R.I.Zubatyuk, S.V.Shishkina, V.V.Dyakonenko, V.V.Medviediev, Role of supramolecular synthons in the formation of the supramolecular architecture of molecular crystals revisited from an energetic viewpoint. // Physical Chemistry Chemical Physics, 2014, v.16, No14, p.6773-6786.

  7. K.Merz, M.V.Evers, F.Uhl, R.I.Zubatyuk, O.V.Shishkin, Role of CHF2- and CF3-substituents on molecular arrangement in the solid state: Experimental and theoretical crystal structure analysis of CH3/CHF2/CF3-substituted benzene. // Crystal Growth and Design, 2014, v.14, No6, p.3124-3130.

  8. D.S.Yufit, O.V.Shishkin, R.I.Zubatyuk, J.A.K.Howard, Trimethyltrioxane (paraldehyde) and its halomethanes complexes: Crystallization, structures, and analysis of packing motifs. // Crystal Growth and Design, 2014, v.14, No9, p.4303-4309.

  9. R.I.Zubatyuk, A.A.Sinelshchikova, Y.Y.Enakieva, Y.G.Gorbunova, A.Y.Tsivadze, S.E.Nefedov, A.Bessmertnykh-Lemeune, R.Guilard, O.V.Shishkin, Insights into the crystal packing of phosphorylporphyrins based on the topology of their intermolecular interaction energies. // CrystEngComm, 2014, v.16, No45, p.10428-10438.

  10. P.-A. Douissard, T. Martin, F. Riva, E. Mathieu, Y. Zorenko, V. Savchyn, T. Zorenko, A. Fedorov. Scintillating Screens for Micro-Imaging Based on the Ce-Tb Doped LuAP Single Crystal Films. IEEE Transactions on Nuclear Science, 2014, 61, 433

  11. H. Przybylińska, A. Wittlin, Chong-Geng Ma, M.G. Brik, A. Kamińska, P. Sybilski, Yu. Zorenko, M. Nikl, V. Gorbenko, A. Fedorov, M. Kučera, A. Suchocki. Rare-earth antisites in lutetium aluminum garnets: Influence on lattice parameter and Ce3+ multicenter structure. Optical Materials, 2014, 36, 1515.

  12. F.M.Dolgushin, A.F.Smol’yakov, K.Yu.Suponitsky, A.V.Vologzhanina, I.V.Fedyanin, S.V.Shishkina Intermolecular interactions in polymorphs of the cyclic trimeric pergluoro-ortho-phenylene mercury from geometric, energetic, and AIM viewpoints: DFT study and Hirshfeld surface analysis // Structural Chemistry, 2016, v.27, p.37-49.

  13. S.V.Shishkina, O.V.Shishkin, V.V.Medviediev, I.V.Omelchenko, A.I.Ismiev, A.M.Magerramov Weak but strong: role of weak C-H...X (X=O, N) hydrogen bonds in organization of crystals of (1S, 2S, 3S, 4R, 5R, 8S)-diethyl-2,4-dicyano-3-(furan-2-yl)-8-morpholino-6-oxobicyclo[3.2.1]octane-2,4-dicarboxylate // Structural Chemistry, 2016, v.27, p.315-321.

  14. S.V.Shishkina, I.V.Ukrainets, L.A.Petrushova Competition between intermolecular hydrogen bonding and stacking in the crystals of 4-hydroxy-N-(pyridin-2-yl)-2,2-dioxo-1H-2λ6 ,1-benzothiazine-3-carboxamides // Zeitchrift für Krisyallodraphie-Crystalline Materials, 2017, v.232, p.307-317

  15. S.V.Shishkina, V.N.Baumer, O.V.Khromileva, L.I.Kucherenko, I.A.Mazur The formation of two thiotriazoline polymorphs: study from the energetic viewpoint // CrystEngComm, 2017, v.19, p.2394-2401.

  16. S.V.Shishkina, V.V.Dyakonenko, O.V.Shishkin, V.Maraval, R.Chauvin Supramolecular architecture of substituted tetraphenyl-carbobrnzenes from the energetic viewpoint // ChemPhysChem, 2017, v.18, p.2499-2508.

  17. S.V.Shishkina, I.S.Konovalova, O.V.Shishkin, A.N.Boyko Acceptor properties of amino groups in aminobenzene crystals: study from the energetic viewpoint // CrystEngComm, 2017, v.19, p.6274-6288.