Supplementary data for article: Stepanović, S.; Anđelković, L.; Zlatar, M.; Anđelković, K. K.; Gruden-Pavlović, M.; Swart, M. Role of Spin State and Ligand Charge in Coordination Patterns in Complexes of 2,6-Diacetylpyridinebis(Semioxamazide) with 3d-Block Metal Ions: A Density Functional Theory Study. Inorganic Chemistry 2013, 52 (23), 13415–13423. https://doi.org/10.1021/ic401752n

Supporting information for: [https://doi.org/10.1021/ic401752n]Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1448

Crystal structures of mixed chloride-azide zinc (II) and chloride-isocyanate cadmium (II) complexes with the condensation product of 2-quinolinecarboxaldehyde and girard’s reagent

The mixed chloride-azide [ZnL(N3)1.65Cl0.35] (1) and chloride-isocyanate [CdL(NCO)1.64Cl0.36] (2) complexes have been prepared in the reactions of (E)-N,N,N-trimethyl-2-oxo-2-(2-(quinolin-2- ylmethylene)hydrazinyl)ethan-1-aminium chloride (HLCl) and the corresponding Zn2+ and Cd2+ salts by adding the NaN3 and NaOCN, respectively. The structures of complexes 1 and 2 were determined by X-ray crystallography

Sinteza i kristalna struktura 1,2,3,4-tetrahidro-9-aminoakridin-tetrahlorocinkata(II) monohidrata

In the reaction of ZnCl(2) with tacrine hydrochloride in water novel tetracoordinated (C(13)H(15)N(2))(2)[ZnCl(4)]-H(2)O complex was obtained and characterized by elemental analysis, molar conductivity and X-ray analysis. The complex crystallizes in the space group P-1 of the triclinic crystal system. The structure contains two crystallographically different molecules of protonated tacrine present as counter cations, the [ZnCl(4)](2-) complex anion and one water solvent molecule. The counter cations slightly differ in the puckering of the cyclohexene ring. The molecules of protonated tacrine are involved in different intermolecular hydrogen bonds. In the crystal, the hydrogen bonding generates a 3D assembly. In the crystal, pi center dot center dot center dot pi stacking interactions between the rings of protonated tacrine were evidenced. The [ZnCl(4)](2-) complex anion has a distorted tetrahedral geometry. Three out of the four Cl atoms are involved in intermolecular hydrogen bonding. The intermolecular H-bond interactions involving the Cl atoms affect the Zn-CI bond lengths.U reakciji ZnCl2 sa takrin-hidrohloridom u vodi, dobijen je novi tetrakoordinovani (C13H15N2)2[ZnCl4]?H2O kompleks koji je okarakterisan pomoću elementalne analize, molarne provodljivosti i rendgenske strukturne analize. Kompleks kristališe u prostornoj grupi P?1 trikliničnog kristalnog sistema. Struktura sadrži dva kristalografski različita molekula protonovanog takrina koji su prisutni kao kontra-katjoni, [ZnCl4]2 kompleksni anjon i molekul kristalne vode. Molekuli katjona se neznatno razlikuju u stepenu nabiranja cikloheksenovog prstena. Molekuli protonovanog takrina su uključeni u različite intermolekulske vodonične veze. Intermolekulsko vodonično vezivanje u kristalu generiše 3D molekulski skup pi...pi interakcije između prstenova protonovanog takrina su primećene u kristalu. [ZnCl4]2- ima distorgovanu tetraedarsku geometriju. Tri od četiri Cl atoma su uključena u intermolekulske vodonične veze. Intermolekulske vodonične interakcije koje uključuju Cl atome utiču na dužinu Zn-Cl veza

Crystal structures of mixed chloride-azide zinc (II) and chloride-isocyanate cadmium (II) complexes with the condensation product of 2-quinolinecarboxaldehyde and girard’s reagent

The mixed chloride-azide [ZnL(N3)1.65Cl0.35] (1) and chloride-isocyanate [CdL(NCO)1.64Cl0.36] (2) complexes have been prepared in the reactions of (E)-N,N,N-trimethyl-2-oxo-2-(2-(quinolin-2- ylmethylene)hydrazinyl)ethan-1-aminium chloride (HLCl) and the corresponding Zn2+ and Cd2+ salts by adding the NaN3 and NaOCN, respectively. The structures of complexes 1 and 2 were determined by X-ray crystallography

Supplementary data for article: Stepanović, S.; Anđelković, L.; Zlatar, M.; Anđelković, K. K.; Gruden-Pavlović, M.; Swart, M. Role of Spin State and Ligand Charge in Coordination Patterns in Complexes of 2,6-Diacetylpyridinebis(Semioxamazide) with 3d-Block Metal Ions: A Density Functional Theory Study. Inorganic Chemistry 2013, 52 (23), 13415–13423. https://doi.org/10.1021/ic401752n

Supporting information for: [https://doi.org/10.1021/ic401752n]Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1448

Visoki antioksidativni potencijal i mali toksični efekat selenosemikarbazonskih kompleksa

Novel metal-based compounds with therapeutic potential have become the subject of intense investigations in inorganic chemistry and biomedical science. Recently, strong dose-dependent cytotoxic activities of selenosemicarbazone metal complexes against several human cancer cell lines were demonstrated. The aim of the present study was to investigate in vitro antioxidative potential of Ni(II), Cd(II) and Zn(II) selenosemicarbazone complexes. All three investigated complexes exhibited high 2,2'-azinobis(3-ethyl-benzothiazoline-6-sulphonic acid) radical cation (ABTS(center dot+)) scavenging capacity, comparable with ascorbic acid. In an acute toxicity study, administration of the compounds was performed orally to mice at single doses. The mice were observed for clinical signs, body weight effects and mortality for 14 days, after which they were sacrificed for gross organ necropsy. The body weight did not vary after administration, and the autoptic analysis failed to show appreciable macroscopic alterations of internal organs. Generally, the compounds exhibited low toxic effects as required for further in vivo therapeutic studies.Nova jedinjenja na bazi metala sa terapeutskim dejstvom postala su predmet istraživanja u neorganskoj hemiji i biomedicinskim naukama. Pokazana je jaka dozno-zavisna citotoksična aktivnost kompleksa selenosemikarbazona na većem broju ćelijskih linija humanih ćelija kancera. Cilj rada je ispitivanje in vitro antioksidativnog dejstva selenosemikarbazonskih kompleksa nikla, cinka i kadmijuma. Sva tri ispitivana kompleksa pokazala su jaku antioksidativnu aktivnost prema ABTS radikalu, uporedivu sa aktivnošću askorbinske kiseline. Tokom ispitivanja akutne toksičnosti, jedinjenja su oralno davana miševima u pojedinačnim dozama i praćeni su klinički znaci, težina tela i mortalitet nakon 14 dana, a potom su životinje žrtvovane radi autopsije organa. Težina tela nije varirala nakon aplikacije. Generalno, jedinjenja su pokazala mali toksični efekat što i zahteva buduće in vivo terapeutsko ispitivanje

2,2 '-{1,1 '-[2,2 '-Oxalylbis(hydrazin-2-yl-1-ylidene)]diethylidyne}dipyridinium bis(perchlorate) dihydrate

The title salt, C(16)H(18)N(6)O(2)(2+)center dot 2ClO(4)(-)center dot 2H(2)O, was obtained unintentionally as a major product in the reaction of Zn(ClO(4))(2)center dot 6H(2)O with the N',N'(2)-bis[(1E)-1-(2-pyridyl)ethylidene]ethanedihydrazide (H(2)L) ligand. The (H(4)L)(2+) cation lies across a centre of inversion. The pyridiniumimine fragments of (H(4)L)(2+) adopt syn orientations. Intramolecular N-H center dot center dot center dot N and N-H center dot center dot center dot O hydrogen bonds lead to the formation of S(5) motifs. In the crystal, neighbouring cations are connected by pi-pi interactions between pyridinium units with a centroid-centroid distance of 3.600 (1) angstrom. Moreover, the crystal components are assembled into two-dimensional layers via N-H center dot center dot center dot O and O-H center dot center dot center dot O hydrogen bonds, with no direct hydrogen-bonding interactions between cations

Sinteza i karakterizacija nikal(II) i bakar(II) kompleksa sa polidentatnim dialkil ditiokarbaminskim ligandom 3-ditiokarboksi-3-aza-5-aminopentanoatom

Square planar complexes of Ni(II) and Cu(II) with potassium 3-dithiocarboxy-3-aza-5-aminopentanoate have been prepared by direct synthesis. The obtained neutral complexes were characterized by elemental analysis, magnetic susceptibility measurements, infrared and electronic spectra. The thermal behaviour of both the Ni(II) and Cu(II) complexes, and the ligand itself was investigated by DSC and TG.Direktnom sintezom između nikal(II)- i bakar(II)- soli i kalijum 3-ditiokarboksi-3-aza-5-aminopentanoata nagrađeni su odgovarajući kompleksi kvadratno-planarne strukture. Izolovani neutralni kompleksi karakterisani su elementalnom analizom, infracrvenom i elektronskom apsorpcionom spektroskopijom, kao i merenjem magnetnih susceptibiliteta. Termičko ponašanje kompleksa i liganda ispitivano je primenom DSC i TG metoda

Supplementary data for article: Filipović, N. R.; Borna, M.; Klisurić, O.; Pregelj, M.; Jagodić, M.; Anđelković, K. K.; Todorović, T. Synthesis, Characterization, and Thermal Behavior of Cu(II) and Zn(II) Complexes with (E)-2-[N-(1-Pyridin-2-Yl-Ethylidene)Hydrazino]Acetic Acid (AphaOH). Crystal Structure of [Zn-2(AphaO)(2)Cl-2]. Journal of Coordination Chemistry 2013, 66 (9), 1549–1560. https://doi.org/10.1080/00958972.2013.786052

Supplementary material for: [https://doi.org/10.1080/00958972.2013.786052]Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1639

Sinteza I karakterizacija kompleksa cinka(II), paladijuma(II) I platine(II) sa 2’-[1-(2-piridinil)etiliden]oksamohidrazidom - kristalna struktura bis {2’-[1-(2-piridinil)etiliden]oksamohidrazido}cink(II) trihidrata

Complexes of Zn(II), Pd(II) and Pt(II) with 2'-[1-(2- pyridinyl)ethyhdene]oxamohydrazide (Hapsox) were synthesized and their structures were determined. All the complexes are of a neutral type with two apsox ligands coordinated to Zn(II) and one apsox ligand coordinated to Pd(II) or Pt(II). In each case. the polydentate was coordinated via pyridine and hydrazone nitrogens and alpha-oxyazine oxygen. forming an octahedral geometry around Zn(II). and a square planar one around Pd(II) and Pt(II). The structure determination was performed by IR. H-1-NMR and C-13-NMR spectroscopy, and for the Zn(II) complex by X-ray structure analysis.U ovom radu opisana je sinteza i strukturna karakterizacija kompleksa Zn(II) Pd(II) i Pt(II) sa 2’-[1-(2-piridinil)etiliden]oksamohidrazidom (Hapsox). Sva tri dobijena kompleksa su neutralnog tipa sa dva koordinovana apsox liganda u slučaju kompleksa Zn(II), odnosno jednim apsox ligandom u slučaju Pd(II) i Pt(II) kompleksa. Koordinacija polidentata je u svim kompleksima ostvarena preko piridinskog azota, hidrazonskog azota i α-oksiazinskog kiseonika gradeći oktaedarsku geometriju oko Zn(II), odnosno kvadratno planarnu geometriju oko Pd(II) i Pt(II).Potvrdu za ovakve strukture dobili smo iz IC 1H-NMR i 13C-NMR spektara, dok je za Zn(II) kompleks urađena i rendgenska strukturna analiza