Search results for "4-THIADIAZOLE"

showing 10 items of 33 documents

First Cobalt(II) Spin Crossover Compound with N4S2-Donorset

2020

Herein we report the synthesis and characterization of a novel bis-tridentate 1,3,4-thiadiazole ligand (L = 2,5-bis[(2-pyridylmethyl)thio]methyl-1,3,4-thiadiazole). Two new mononuclear complexes of the type [MII(L)2](ClO4)2 (with M = FeII (C1) and CoII (C2)) have been synthesized, containing the new ligand (L). In both complexes the metal centers are coordinated by an N4S2-donorset and each of the two ligands is donating to the metal ion with just one of the tridentate pockets. The iron(II) complex (C1) is in the low spin [LS] state below room temperature and shows an increase in the magnetic moment only above 300 K. In contrast, the cobalt(II) complex (C2) shows a gradual spin crossover (S…

MagnetismPharmaceutical Sciencechemistry.chemical_elementThio-n<sub>4</sub>s<sub>2</sub>-donorsetAnalytical Chemistrylcsh:QD241-441Metalspin crossoverlcsh:Organic chemistrySpin crossoverDrug DiscoveryPhysical and Theoretical ChemistrySpin (physics)134-thiadiazolecobalt(ii)Magnetic momentLigandOrganic Chemistryiron(ii)CrystallographychemistryChemistry (miscellaneous)magnetismvisual_artvisual_art.visual_art_mediumMolecular MedicineCobaltMolecules
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Synthesis and characterization of a Cu(II) complex of 2-benzylmercapto-5- methyl-1,3,4-thiadiazole (C10H10N2S 2)

2008

A Cu(II) complex of 2-benzylmercapto-5-methyl-1,3,4-thiadiazole was synthesized and characterized. The crystal structure of the copper complex and the free ligand were determined by single-crystal X-ray diffraction at room temperature: {[Cu(C10H10N2S2) 2(Cl)2], P1 triclinic, a = 8.1450(2) Å, b = 8.1690(2) Å, c = 10.8180(3) Å, α = 97.4040(12)°, β = 101.6270(11)°, γ = 116.1431(14)°; C10H10N2S2 ligand, Pbca orthorhombic, a = 8.7938(7) Å, b = 9.6491(7) Å, c = 25.3552(18) Å}. The metal complex framework consists of discrete units that provide crystalline stability through a network of van der Waals contacts. The Cu(II) is coordinated by two chloride ions and two 2-benzylmercapto-5-methyl-1,3,4- …

DenticityLigandChemistryCiencias FísicasSPECTROSCOPIC BEHAVIORCrystal structureTriclinic crystal systemCU(II) COMPLEXESMagnetic susceptibilityMAGNETIC BEHAVIORCRYSTAL STRUCTUREMetal2-BENZYLMERCAPTO-5-METHYL-134-THIADIAZOLEAstronomíaCrystallographysymbols.namesakevisual_artMaterials Chemistryvisual_art.visual_art_mediumsymbolsOrthorhombic crystal systemPhysical and Theoretical Chemistryvan der Waals forceCIENCIAS NATURALES Y EXACTAS
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A competitive reactivity study on the oxidative cyclization of thiosemicarbazones into 1,3,4-thiadiazoles

2022

Abstract In order to obtain useful insights on the mechanism of formation of 2(3H)-imino-1,3,4-thiadiazoles by oxidative cyclization of aldehyde thiosemicarbazones with Cu(II) or Fe(III) salts, a competitive reactivity study was performed on a suitable set of diversely substituted substrates, by means of HPLC techniques. This approach enabled to exploit Hammett’s equation without performing otherwise difficult-to-run kinetic experiments. The results presented herein support the hypothesis that the formation of the thiadiazole ring is induced by the attack of the oxidizing Lewis acid metal cation onto the imine-like nitrogen atom of the thiosemicarbazone substrate. Beyond mechanistic interpr…

thiosemicarbazonesOrganic ChemistrySettore CHIM/06 - Chimica OrganicaCopper(II) chlorideoxidative cyclization134-thiadiazoleArkivoc
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Crystal structure of bis[2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole-κ2N2,N3]bis(thiocyanato-κS)copper(II)

2016

The structure of the title compound is similar to that of the related complexes [Co(C12H8N4S)2(N3)2] and [Ni(C12H8N4S)2(N3)2] in which the azide ion is substituted by the thio­cyanate group. The CuN4S2 octa­hedron is more distorted than the CoN6 and NiN6 octa­hedra.

crystal structureStereochemistrychemistry.chemical_elementThio-Crystal structure010402 general chemistry010403 inorganic & nuclear chemistry01 natural sciencesChlorideResearch CommunicationsMetalchemistry.chemical_compoundmedicine25-bis(pyridin-2-yl)-134-thiadiazoleGeneral Materials Sciencecopper complexCoordination geometrythio­cyanate ligandCrystallographyHydrogen bondGeneral Chemistrythiocyanate ligandCondensed Matter PhysicsCopper0104 chemical sciencesCrystallographychemistryQD901-999visual_artvisual_art.visual_art_mediumDiazole25-bis­(pyridin-2-yl)-134-thia­diazolemedicine.drugActa Crystallographica Section E Crystallographic Communications
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Synthesis and antimicrobial screening of tetra Schiff bases of 1,2,4,5-tetra (5-amino-1,3,4-thiadiazole-2-yl)benzene

2014

Abstract In the present study, novel tetra Schiff bases were synthesized by condensation of 1,2,4,5-tetra (5-amino-1,3,4-thiadiazole-2-yl)benzene with different aromatic aldehydes. The chemical structures were confirmed by means of IR, 1 H NMR, 13 C NMR, and elemental analysis. All compounds were screened for antibacterial ( Staphylococcus aureus ATCC-9144, Staphylococcus epidermidis ATCC-155, Micrococcus luteus ATCC-4698, Bacillus cereus ATCC-11778, Escherichia coli ATCC-25922, and Pseudomonas aeruginosa ATCC-2853) and antifungal ( Aspergillus niger ATCC-9029 and Aspergillus fumigatus ATCC-46645) activities by paper disc diffusion technique. The minimum inhibitory concentrations (MICs) of …

Chemistry(all)biologyChemistryStereochemistryAspergillus nigerBacillus cereus134-ThiadiazoleGeneral Chemistrybiology.organism_classificationAntimicrobialAntifungalAspergillus fumigatusAntibacterialStaphylococcus epidermidisProton NMRTetraTetra Schiff baseMicrococcus luteusNuclear chemistryJournal of Saudi Chemical Society
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Crystal structure of bis-(azido-κN)bis[2,5-bis(pyridin-2-yl)-1,3,4-thia-diazole-κ(2) N (2),N (3)]cobalt(II).

2015

The structure of the title compound is isotypic with that of the analogous nickel(II) complex, in which the CoN6 core shows an axially weakly compressed octa­hedral geometry as opposed to the almost regular geometry exhibited by the NiN6 octa­hedron.

crystal structureDenticityStereochemistryπ–π inter­actionsCrystal structuretransition metalResearch Communicationslcsh:Chemistrychemistry.chemical_compoundazide compounds25-bis­(pyridin-2-yl)-134-thia­diazole ligandPyridineGeneral Materials ScienceChemistryLigandGeneral ChemistryCondensed Matter Physicshydrogen bondingCrystallographylcsh:QD1-99925-bis(pyridin-2-yl)-134-thiadiazole ligandπ–π interactionsDiazoleSodium azideAzideTrifluoromethanesulfonateActa crystallographica. Section E, Crystallographic communications
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CCDC 140608: Experimental Crystal Structure Determination

2001

Related Article: E.Borras, G.Alzuet, J.Borras, J.Server-Carrio, A.Castineiras, M.Liu-Gonzalez, F.Sanz-Ruiz|2000|Polyhedron|19|1859|doi:10.1016/S0277-5387(00)00474-5

Space GroupCrystallographybis(4-Amino-N-(5-methyl-134-thiadiazole-2-yl-5-ylidene)sulfanilamide)-aqua-bis(pyridine)-copper(ii) monohydrateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1949845: Experimental Crystal Structure Determination

2020

Related Article: Fabian Fürmeyer, Luca M. Carrella, Vadim Ksenofontov, Angela Möller, Eva Rentschler|2020|Inorg.Chem.|59|2843|doi:10.1021/acs.inorgchem.9b03170

Space GroupCrystallographyCrystal SystemCrystal Structurebis(mu-25-bis{[(thiazol-2-ylmethyl)-amino]-methyl}-134-thiadiazole)-di-iron(ii) tetrakis(perchlorate) acetonitrile solvateCell ParametersExperimental 3D Coordinates
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CCDC 1949842: Experimental Crystal Structure Determination

2020

Related Article: Fabian Fürmeyer, Luca M. Carrella, Vadim Ksenofontov, Angela Möller, Eva Rentschler|2020|Inorg.Chem.|59|2843|doi:10.1021/acs.inorgchem.9b03170

Space GroupCrystallographyCrystal SystemCrystal Structurebis(mu-25-bis{[(thiazol-2-ylmethyl)-amino]-methyl}-134-thiadiazole)-di-iron(ii) tetrakis(perchlorate) acetonitrile solvateCell ParametersExperimental 3D Coordinates
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CCDC 730598: Experimental Crystal Structure Determination

2017

Related Article: Jorge R. A. Diaz, Gerardo Enrique Cami, Malva Liu-Gonzalez, Daniel R. Vega, Daniela Vullo, Americo Juarez, Jose C. Pedregosa and Claudiu T. Supuran|2016|J.Enzyme Inhib.Med.Chem.|31|1102|doi:10.3109/14756366.2015.1096270

Space GroupCrystallographyCrystal System4-methylbenzene-1-sulfonic acid 5-amino-134-thiadiazole-2-sulfonamideCrystal StructureCell ParametersExperimental 3D Coordinates
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