Search results for "Octahedral molecular geometry"

showing 10 items of 68 documents

Halogen⋯halogen interactions in the self-assembly of one-dimensional 2,2′-bipyrimidine-based CuIIReIV systems

2018

Two one-dimensional CuIIReIV coordination polymers of the general formula {[ReIVCl4(μ-bpym)CuIIX2]·solvent}n [where bpym = 2,2′-bipyrimidine, X = Cl (1) and Br (2), and solvent = H2O (1) and CHCl3 (2)] have been prepared and characterised structurally and magnetically. Both compounds crystallise in the monoclinic system with space groups P21/c (1) and P21/n (2). Each CuII ion is bonded to two cis nitrogen atoms from the bpym ligand and to four halogen atoms. Two of these halogen atoms are placed in the equatorial plane and the other two are filling the axial positions of the CuII ion, thus generating a distorted octahedral environment for this metal ion in 1 and 2. In both compounds, the Re…

Materials science010405 organic chemistryHydrogen bondIntermolecular forceSpace groupGeneral Chemistry010402 general chemistryCondensed Matter Physics01 natural sciencesMagnetic susceptibility0104 chemical sciencesCrystallographyIntramolecular forceOctahedral molecular geometryHalogenGeneral Materials ScienceMonoclinic crystal systemCrystEngComm
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Ferromagnetic exchange interaction in a new Ir(iv)-Cu(ii) chain based on the hexachloroiridate(iv) anion.

2019

The iridium(IV) complex (NBu4)2[IrCl6] (1) has been synthetised, characterised and used as a precursor to prepare the new chloro-bridged heterobimetallic IrIV–CuII chain of formula {IrCl5(μ-Cl)Cu(viim)4}n (2) [viim = 1-vinylimidazole]. The crystal structure and magnetic properties of 1 and 2 have been investigated. Both compounds crystallise in the monoclinic system with space group C2/c. Each IrIV ion in both 1 and 2 is six-coordinate and bonded to six chloride ions in a regular octahedral geometry. In compound 2, the CuII ion exhibits an axially elongated octahedron with four N atoms, from four monodentate viim ligands, that form the equatorial plane, and two chloride ions that occupy the…

Materials scienceDenticity010405 organic chemistryCrystal structure010402 general chemistry01 natural sciencesMagnetic susceptibility0104 chemical sciencesInorganic ChemistryCrystalCrystallographyMagnetizationFerromagnetismOctahedral molecular geometryMonoclinic crystal systemDalton transactions (Cambridge, England : 2003)
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Cyano-Bridged Bimetallic Assemblies from Hexacyanometalate, [M(CN)6]3- (M = MnIII and FeIII), and [M(N4-macrocycle)]2+ (M = FeIII, NiII and ZnII) Bui…

2001

Reactions between [M(N4-macrocycle)]2+ (M = ZnII and NiII; macrocycle ligands are either CTH = d,l-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane or cyclam = 1,4, 8, 11-tetrazaazaciclotetradecane) and [M(CN)6]3- (M = FeIII and MnIII) give rise to cyano-bridged assemblies with 1D linear chain and 2D honeycomblike structures. The magnetic measurements on the 1D linear chain complex [Fe(cyclam)][Fe(CN)6]·6H2O 1 points out its metamagnetic behavior, where the ferromagnetic interaction operates within the chain and the antiferromagnetic one between chains. The Neel temperature, TN, is 5.5 K and the critical field at 2 K is 1 T. The unexpected ferromagnetic intrachain interaction can…

MineralogyInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryFerromagnetismCyclamOctahedral molecular geometryAntiferromagnetismPhysical and Theoretical ChemistryIsostructuralBimetallic stripCritical fieldNéel temperatureInorganic Chemistry
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Synthesis, characterization, cellular uptake and interaction with native DNA of a bis(pyridyl)-1,2,4-oxadiazole copper(II) complex

2010

The copper(II) complex of 3,5-bis(2'-pyridyl)-1,2,4-oxadiazole was synthesized and characterized. X-Ray crystallography revealed that the complex consists of a discrete [Cu(3,5-bis(2'-pyridyl)-1,2,4-oxadiazole)(2)(H(2)O)(2)](2+) cation and two ClO(4)(-) anions. The Cu(II) coordination sphere has a distorted octahedral geometry and each ligand chelates the copper ion through the N(4) nitrogen of the oxadiazole ring and the nitrogen of one pyridine moiety. The coordinated water molecules are in cis position and each of them is H-bonded to the 5-pyridyl nitrogen of the oxadiazole ligand and to an oxygen of the perchlorate anion. Biological assays showed that, despite the free ligand not being …

Models MolecularCircular dichroismCoordination sphereheterocylces metal complex DNA binders anti-tumoralsCell SurvivalPyridinesStereochemistrychemistry.chemical_elementOxadiazoleLigandsInorganic Chemistrychemistry.chemical_compoundPerchlorateCell Line TumorOctahedral molecular geometryOrganometallic CompoundsHumansOxadiazolesChemistryLigandDNASettore CHIM/06 - Chimica OrganicaCopperBinding constantCrystallographySettore CHIM/03 - Chimica Generale E InorganicaCopper
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Iron-Promoted Nucleophilic Additions to Diimine-Type Ligands:  A Synthetic and Structural Study

2003

We report here three examples of the reactivity of protic nucleophiles with diimine-type ligands in the presence of Fe(II) salts. In the first case, the iron-promoted alcoholysis reaction of one nitrile group of the ligand 2,3-dicyano-5,6-bis(2-pyridyl)-pyrazine (L1) permitted the isolation of an stable E-imido-ester, [Fe(L1')(2)](CF(3)SO(3))(2) (1), which has been characterized by spectroscopic studies (IR, ES-MS, Mössbauer), elemental analysis, and crystallographically. Compound 1 consists of mononuclear octahedrally coordinated Fe(II) complexes where the Fe(II) ion is in its low-spin state. The iron-mediated nucleophilic attack of water to the asymmetric ligand 2,3-bis(2-pyridyl)pyrido[3…

NitrilePyrazineStereochemistryLigandCrystal structureInorganic Chemistrychemistry.chemical_compoundCrystallographyNucleophilechemistryOctahedral molecular geometryReactivity (chemistry)Physical and Theoretical ChemistryDiimineInorganic Chemistry
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Synthesis, characterization, and in vitro antimicrobial activity of organotin(IV) complexes with triazolo-pyrimidine ligands containing exocyclic oxy…

2005

Abstract Tri-organotin(IV) complexes of the triazolo-pyrimidine derivatives 4,5-dihydro-5-oxo-[1,2,4]triazolo-[1,5 a ]pyrimidine (5HtpO), 4,7-dihydro-5-methyl-7-oxo-[1,2,4]triazolo-[1,5 a ]pyrimidine (HmtpO), and 4,5,6,7-tetrahydro-5,7-dioxo-[1,2,4]triazolo-[1,5 a ]pyrimidine (H 2 tpO 2 ), and the diorganotin derivative n -Bu 2 Sn(tpO 2 ), were synthesized and characterized by means of infrared and 119 Sn Mossbauer spectroscopy. In all the complexes obtained the triazolopyrimidines act as multidentate ligands producing polymeric structures. A trigonal bipyramidal arrangement of the ligands around the tin atom is proposed for triorganotin(IV) derivatives, with organic groups on the equatoria…

ONIOMDenticityPyrimidineStereochemistryLigandOrganic ChemistryDFT calculationTriazolopyrimidine; Organotin(IV); Mossbauer; DFT calculations; Antimicrobial activityOrganotin(IV)Antimicrobial activityBiochemistryMedicinal chemistryMossbauerInorganic Chemistrychemistry.chemical_compoundTrigonal bipyramidal molecular geometrychemistryMössbauer spectroscopyOctahedral molecular geometryMaterials ChemistryTriazolopyrimidineChelationPhysical and Theoretical ChemistryJournal of Organometallic Chemistry
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Complexes of Co(II) and Zn(II) with ofloxacin. Crystal structure of [Co(oflo)2(MeOH)2].4MeOH.

2002

Abstract Ofloxacin (oflo) is able to interact with Co(II) and Zn(II) salts to form complexes with the general formula [M(oflo) 2 ] · 4H 2 O, (M = Co, Zn). Bonding takes place through one of the oxygen atoms of the carboxylate group (acting as a monodentate) and the oxygen atom of the ketonic group. The IR bands of the carboxylic and ketonic group at 1713 and 1622 cm −1 , respectively, shift to 1615 and 1575 cm −1 in the complexes. After dissolution in methanol, complex [Co(oflo) 2 ] · 4H 2 O crystallizes as [Co(oflo) 2 (MeOH) 2 ] · 4MeOH, where Co(II) ion is in an octahedral environment of oxygen atoms. This compound crystallizes in the triclinic system, spatial group P‐1, with unit cell di…

OfloxacinDenticityChemistry PharmaceuticalAnalytical chemistryPharmaceutical ScienceInfrared spectroscopyCrystal structureCobaltTriclinic crystal systemCrystallography X-Raychemistry.chemical_compoundCrystallographyZincchemistryOctahedronOctahedral molecular geometryCarboxylateCrystallizationAntibacterial agentJournal of pharmaceutical sciences
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Bioactive Co(II), Ni(II), and Cu(II) Complexes Containing a Tridentate Sulfathiazole-Based (ONN) Schiff Base

2021

New Co(II), Ni(II), and Cu(II) complexes were synthesized with the Schiff base ligand obtained by the condensation of sulfathiazole with salicylaldehyde. Their characterization was performed by elemental analysis, molar conductance, spectroscopic techniques (IR, diffuse reflectance and UV–Vis–NIR), magnetic moments, thermal analysis, and calorimetry (thermogravimetry/derivative thermogravimetry/differential scanning calorimetry), while their morphological and crystal systems were explained on the basis of powder X-ray diffraction results. The IR data indicated that the Schiff base ligand is tridentate coordinated to the metallic ion with two N atoms from azomethine group and thiazole ring a…

Pharmaceutical ScienceOrganic chemistrythermal behaviorArticleAnalytical Chemistrychemistry.chemical_compoundSchiff baseQD241-441sulfathiazoleantibacterial activityNickelDrug DiscoveryOctahedral molecular geometryMoleculePhysical and Theoretical ChemistryThiazoleSchiff BasesSulfathiazolesSchiff baseChemistryLigandSpectrum AnalysisCobaltAnti-Bacterial AgentsThermogravimetryCrystallographySalicylaldehydeChemistry (miscellaneous)Molecular MedicineCo(II) Ni(II) and Cu(II) complexesCopperMonoclinic crystal systemMolecules
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Chains and channels in polynuclear copper(II) complexes with 2,3-bis(2-pyridyl)pyrazine (dpp) as bridging ligand; syntheses, crystal structures and m…

2000

Abstract The preparation and crystal structures for three Cu(II) polynuclear, chain complexes with 2,3-bis(2-pyridyl)pyrazine (dpp) as bridging ligand are reported, [Cu(dpp)(H2O)2]n(NO3)2n·2n/3H2O (1), [Cu(dpp)(H2O)2]n(CF3SO3)2n (2), and [Cu(dpp)(H2O)2]n(BF4)2n·2nH2O (3). For the latter compound the crystal structure at four different temperatures have been studied. Variable-temperature magnetic susceptibility data and ESR measurements of 1–3 and of the related copper(II) chain [Cu(dpp)(H2O)2]n(ClO4)2n·2nH2O (4) (whose structure was previously reported) have been performed. Compounds 1 and 2 crystallize in the same trigonal space group, R 3 c; 3 is orthorhombic, space group Pbca. Complexes …

PyrazineBridging ligandCrystal structureMagnetic susceptibilityInorganic ChemistryCrystallographychemistry.chemical_compoundchemistryOctahedronOctahedral molecular geometryMaterials ChemistryOrthorhombic crystal systemPhysical and Theoretical ChemistryCoordination geometryInorganica Chimica Acta
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Double azido/cyanato bridged copper(II) dimers incorporating tridentate nitrogen donors Schiff base: Structure, EPR and magnetic studies

2015

Abstract A neutral tridentate nitrogen donor Schiff base ligand L (L = (E)-N-(phenyl(pyridin-2-yl)methylene)-2-(pyridin-2-yl)ethanamine) has been synthesized and characterized by spectroscopic techniques, and employed to synthesize two new μ1,1-azido/cyanato bridged dinuclear copper(II) complexes, [Cu(L)(μ1,1-N3)(ClO4)]2 (1) and [Cu(L)(μ1,1-NCO)(ClO4)]2 (2). Both compounds have been spectroscopically and structurally characterized. Structural investigation reveals centro-symmetric nature of the complexes in which the center of inversion lies at the midpoint of the two copper(II) ions. The metal ions display distorted octahedral geometry. The tridentate neutral ligand L coordinates the metal…

Schiff baseChemistryHydrogen bondStereochemistryLigandchemistry.chemical_elementCrystal structureCopperlaw.inventionInorganic Chemistrychemistry.chemical_compoundCrystallographylawOctahedral molecular geometryMaterials ChemistryPhysical and Theoretical ChemistryMethyleneElectron paramagnetic resonancePolyhedron
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