{"data":{"id":"10.6084/m9.figshare.1610410.v2","type":"dois","attributes":{"doi":"10.6084/m9.figshare.1610410.v2","prefix":"10.6084","suffix":"m9.figshare.1610410.v2","identifiers":[],"alternateIdentifiers":[],"creators":[{"name":"A. S. Kuzovlev","affiliation":[],"nameIdentifiers":[]},{"name":"E. V. Savinkina","affiliation":[],"nameIdentifiers":[]},{"name":"V. V. Chernyshev","affiliation":[],"nameIdentifiers":[]},{"name":"M. S. Grigoriev","affiliation":[],"nameIdentifiers":[]},{"name":"A. N. Volov","affiliation":[],"nameIdentifiers":[]}],"titles":[{"title":"Copper and palladium complexes with substituted pyrimidine-2-thiones and 2-thiouracils: syntheses, spectral characterization, and X-ray crystallographic study"}],"publisher":"Taylor \u0026 Francis","container":{},"publicationYear":2016,"subjects":[{"subject":"Biophysics"},{"subject":"Biochemistry"},{"subject":"29999 Physical Sciences not elsewhere classified","subjectScheme":"FOR"},{"subject":"FOS: Physical sciences","schemeUri":"http://www.oecd.org/science/inno/38235147.pdf","subjectScheme":"Fields of Science and Technology (FOS)"},{"subject":"FOS: Physical sciences","subjectScheme":"Fields of Science and Technology (FOS)"},{"subject":"Cell Biology"},{"subject":"Physiology"},{"subject":"FOS: Biological sciences","schemeUri":"http://www.oecd.org/science/inno/38235147.pdf","subjectScheme":"Fields of Science and Technology (FOS)"},{"subject":"FOS: Biological sciences","subjectScheme":"Fields of Science and Technology (FOS)"},{"subject":"Biotechnology"},{"subject":"39999 Chemical Sciences not elsewhere classified","subjectScheme":"FOR"},{"subject":"FOS: Chemical sciences","schemeUri":"http://www.oecd.org/science/inno/38235147.pdf","subjectScheme":"Fields of Science and Technology (FOS)"},{"subject":"FOS: Chemical sciences","subjectScheme":"Fields of Science and Technology (FOS)"}],"contributors":[],"dates":[{"date":"2016-02-15","dateType":"Created"},{"date":"2016-02-15","dateType":"Updated"},{"date":"2016","dateType":"Issued"}],"language":null,"types":{"ris":"DATA","bibtex":"misc","citeproc":"dataset","schemaOrg":"Dataset","resourceType":"Dataset","resourceTypeGeneral":"Dataset"},"relatedIdentifiers":[{"relationType":"IsSupplementTo","relatedIdentifier":"10.1080/00958972.2015.1123696","relatedIdentifierType":"DOI"},{"relationType":"IsIdenticalTo","relatedIdentifier":"10.6084/m9.figshare.1610410","relatedIdentifierType":"DOI"}],"relatedItems":[],"sizes":["782543 Bytes"],"formats":[],"version":null,"rightsList":[{"rights":"Creative Commons Attribution 4.0 International","rightsUri":"https://creativecommons.org/licenses/by/4.0/legalcode","schemeUri":"https://spdx.org/licenses/","rightsIdentifier":"cc-by-4.0","rightsIdentifierScheme":"SPDX"}],"descriptions":[{"description":"Copper(I) and palladium(II) complexes containing 5-acetyl-6-methyl-1,2,3,4-tetrahydropyrimidine-2-thione (L\u003csup\u003e1\u003c/sup\u003e), ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (L\u003csup\u003e2\u003c/sup\u003e), \u003ci\u003ecis\u003c/i\u003e-5-acetyl-6-ethyl-5,6-dihydro-2-thiouracil (L\u003csup\u003e3\u003c/sup\u003e), and 5,6-dihydro-2-thiouracil (L\u003csup\u003e4\u003c/sup\u003e) have been synthesized. All complexes were characterized by elemental analysis, IR, \u003csup\u003e1\u003c/sup\u003eH, and \u003csup\u003e13\u003c/sup\u003eC NMR spectroscopy. To assign bands in the IR spectra of L\u003csup\u003e1\u003c/sup\u003e and L\u003csup\u003e2\u003c/sup\u003e and complexes with Cu(I) and Pd(II), deuterium substitution of movable protons at N-atoms was used. The crystal structures of two compounds, [Cu(L\u003csup\u003e2\u003c/sup\u003e)\u003csub\u003e2\u003c/sub\u003eCl] and [Pd(L\u003csup\u003e4\u003c/sup\u003e)\u003csub\u003e2\u003c/sub\u003eCl\u003csub\u003e2\u003c/sub\u003e], were determined by X-ray single-crystal and powder diffraction, respectively. In [Cu(L\u003csup\u003e2\u003c/sup\u003e)\u003csub\u003e2\u003c/sub\u003eCl], copper has a rare coordination number of three and triangular surrounding of two neutral L\u003csup\u003e2\u003c/sup\u003e molecules, coordinated through sulfurs, and chloride. In [Pd(L\u003csup\u003e4\u003c/sup\u003e)\u003csub\u003e2\u003c/sub\u003eCl\u003csub\u003e2\u003c/sub\u003e], palladium has a standard square-planar geometry, formed by two uracil molecules and two chlorides. A new method for the synthesis of 5,6-dihydro-2-thiouracil, starting from β-aminopropionic acid, was suggested.","descriptionType":"Abstract"}],"geoLocations":[],"fundingReferences":[],"xml":"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