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List of works by Roman I. Zubatyuk

14-(2,3-Dichloro-phen-yl)-9,10-dimethyl-benzimidazo[1,2-a]benzo[f][1,8]naphthyridine-6-carbonitrile.

scientific article

Accurate and transferable multitask prediction of chemical properties with an atoms-in-molecules neural network

scientific article published on 09 August 2019

Approaching coupled cluster accuracy with a general-purpose neural network potential through transfer learning ⬇️

scientific article published on 01 July 2019

Aromaticity-controlled tautomerism and resonance-assisted hydrogen bonding in heterocyclic enaminone-iminoenol systems

scientific article published on 01 February 2007

Bis(μ-4-nitro-2-{[2-(oxidomethyl)phenyl]iminomethyl}phenolato)bis[chlorido(dimethyl sulfoxide)iron(III)] dimethyl sulfoxide disolvate ⬇️

scientific article published on April 25, 2012

Bis[N-(2-amino-eth-yl)ethane-1,2-diamine-κN,N',N'']copper(II) tris-[diamminetetra-kis-(thio-cyanato-κN)chromate(III)] thio-cyanate dimethyl sulfoxide tetra-deca-solvate monohydrate

scientific article published on 6 July 2011

Bis{μ(2)-2-[(2-hy-droxy-eth-yl)(meth-yl)amino]-ethano-lato}bis-(μ(3)-N-methyl-2,2'-aza-nediyldiethano-lato)tetra-kis-(thio-cyan-atato-κN)dichromium(III)dimanganese(II) dimethyl-formamide tetra-solvate

scientific article published on 30 November 2011

Chiral ureas with two electronegative substituents at 1-N: an unusual case of coexisting pyramidal and almost planar 1-N atoms in the same crystal

scientific article

Chlorido-bis-(1,10-phenanthroline-κ(2) N,N')copper(II) chlorido-(1,10-phen-anthroline-κ(2) N,N')(pyridine-2,6-di-carboxyl-ato-κ(3) O (2),N,O (6))manganate(II) methanol monosolvate.

scientific article published on 29 March 2014

Complexation of molecular clips containing fragments of diphenylglycoluril and benzocrown ethers with paraquat and its derivatives

scientific article published on 4 October 2017

Cr(III)-Cr(III) interactions in two alkoxo-bridged heterometallic Zn2Cr2 complexes self-assembled from zinc oxide, Reinecke's salt, and diethanolamine

scientific article published on June 2010

Crystal structure of 4-tert-butyl-2-{2-[N-(3,3-dimethyl-2-oxobut-yl)-N-iso-propyl-carbamo-yl]phen-yl}-1-isopropyl-1H-imidazol-3-ium perchlorate

scientific article

Diaquabis(propane-1,3-diamine)copper(II) bis[diamminetetrakis(thiocyanato-κN)chromate(III)] dimethyl sulfoxide octasolvate ⬇️

scientific article published on June 4, 2011

Direct synthesis, crystal structures, high-field EPR, and magnetic studies of heterometallic polymers containing manganese(II) carboxylates interconnected by [Cu(en)2]2+

scientific article published on 07 May 2008

Ethyl 1,6-dimethyl-2-oxo-4-(quinolin-4-yl)-1,2,3,4-tetra-hydro-pyrimidine-5-carboxyl-ate.

scientific article

Exploration of density functional methods for one-electron reduction potential of nitrobenzenes

scientific article published on 01 January 2010

Homonuclear versus heteronuclear resonance-assisted hydrogen bonds: tautomerism, aromaticity, and intramolecular hydrogen bonding in heterocyclic systems with different exocyclic proton donor/acceptor

scientific article published on 01 March 2009

Influence of deuteration and fluorination on the supramolecular architecture of pyridine N-oxide crystals

scientific article published on 09 October 2012

Role of supramolecular synthons in the formation of the supramolecular architecture of molecular crystals revisited from an energetic viewpoint

scientific article published on 05 March 2014

Tetra-kis(μ(2)-cyanido-κ(2)C:N)dicyanido-tetra-kis-[tris-(2-amino-eth-yl)amine-κ(3)N,N',N'',N''']tetra-copper(II)iron(II) bis[pentacyanidonitrosoferrate(II)] hexahydrate.

scientific article

The C–Cl⋯π interactions inside supramolecular nanotubes of hexaethynylhexamethoxy[6]pericyclyne

scientific article published on 14 March 2011

Tris(2,2'-bipyridine)-copper(II) penta-cyanido-nitro-soferrate(II) methanol disolvate monohydrate

scientific article published on 16 March 2013

Two polymorphs of morpholin-4-ium 2-(5-methyl-1H-1,2,4-triazol-3-ylsulfanyl)acetate

scientific article published on 23 December 2008

d(A)3d(T)3 and d(G)3d(C)3 B-DNA mini-helixes: the DFT/M06-2x and DFT/B97-D3 comparison of geometrical and energetic characteristics.

scientific article published on 26 September 2017

trans-Chloridobis-(ethane-1,2-di-amine-κ(2) N,N')(thio-cyanato-κN)cobalt(III) diammine-tetra-kis-(thio-cyanato-κN)cromate(III).

scientific article published on 26 February 2014

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