Search results for "organometallic compounds"

showing 10 items of 240 documents

Self-ordering of metallogrid complexes via directed hydrogen-bonding.

2012

Reaction of imidazole aldehydes with dihydrazino derivatives of 2-phenylpyrimidine provides a family of bis(acylhydrazone) ligands which form [2 × 2] metallogrid complexes with transition metal ions including Fe(II), Co(II), Cu(II) and Zn(II). The free ligands show H-bonding interactions, both donor and acceptor, largely involving the imidazole units, while binding of the metal ions occupies all the acceptor sites and leaves only the pyrrolic-NH site as an H-bond donor, although its deprotonation by a strong base can regenerate an acceptor. These H-bonding interactions have been studied by (1)H NMR spectroscopy in solution and in the solid state by means of several crystal structure determi…

Models MolecularAldehydesMolecular StructureHydrogen bondMetal ions in aqueous solutionHydrazonesImidazolesHydrogen BondingCrystal structureAtmospheric temperature rangePhotochemistryLigandsAcceptorInorganic Chemistrychemistry.chemical_compoundCrystallographyDeprotonationchemistryOrganometallic CompoundsTransition ElementsImidazoleta116Self orderingDalton transactions (Cambridge, England : 2003)
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Antisymmetric exchange in triangular tricopper(II) complexes: correlation among structural, magnetic, and electron paramagnetic resonance parameters.

2011

Two new trinuclear copper(II) complexes, [Cu(3)(μ(3)-OH)(daat)(Hdat)(2)(ClO(4))(2)(H(2)O)(3)](ClO(4))(2)·2H(2)O (1) and [Cu(3)(μ(3)-OH)(aaat)(3)(H(2)O)(3)](ClO(4))(2)·3H(2)O (2) (daat = 3,5-diacetylamino-1,2,4-triazolate, Hdat = 3,5-diamino-1,2,4-triazole, and aaat = 3-acetylamino-5-amino-1,2,4-triazolate), have been prepared from 1,2,4-triazole derivatives and structurally characterized by X-ray crystallography. The structures of 1 and 2 consist of cationic trinuclear copper(II) complexes with a Cu(3)OH core held by three N,N-triazole bridges between each pair of copper(II) atoms. The copper atoms are five-coordinate with distorted square-pyramidal geometries. The magnetic properties of 1 …

Models MolecularAntisymmetric exchangeMolecular StructureX-rayCationic polymerizationElectron Spin Resonance SpectroscopyTemperaturechemistry.chemical_elementCrystal structureAtmospheric temperature rangeTriazolesCrystallography X-RayLigandsCopperlaw.inventionInorganic ChemistryCrystallographyMagneticschemistrylawOrganometallic CompoundsMoleculePhysical and Theoretical ChemistryElectron paramagnetic resonanceCopperInorganic chemistry
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Nuclease activity of [Cu(sulfathiazolato)2(benzimidazole)2]2MeOH. Synthesis, properties and crystal structure

2002

The [Cu(sulfathiazolato)(2)(benzimidazole)(2)]2MeOH complex has been synthesised and characterised. It crystallises in the monoclinic system, space group C1c1, with unit cell dimensions a=18.829(7) A, b=12.206(3) A, c=17.233(5) A, alpha=90.06(2) degrees, beta=97.28(3) degrees, gamma=90.21(3) degrees and Z=4. The geometry around the copper(II) ion is intermediate between tetrahedral and square planar. The complex produces cleavage of plasmid pUC18 in presence of reducing agents. The efficiency of cleavage reaction of the title compound with pUC18 and with different reducing agents follows the order ascorbate-H(2)O(2)>ascorbate>MPA>dithiothreitol>H(2)O(2).

Models MolecularBenzimidazoleSpectrophotometry InfraredReducing agentMolecular Conformationchemistry.chemical_elementCrystal structureCrystallography X-RayCleavage (embryo)BiochemistryDithiothreitolInorganic ChemistryStructure-Activity Relationshipchemistry.chemical_compoundSulfathiazoleOrganometallic CompoundsGroup 2 organometallic chemistrySulfathiazolesDeoxyribonucleasesMethanolElectron Spin Resonance SpectroscopyCopperCrystallographychemistryBenzimidazolesCopperPlasmidsMonoclinic crystal systemJournal of Inorganic Biochemistry
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A Germanium Isocyanide Complex Featuring (n -> π*) Back-Bonding and Its Conversion to a Hydride/Cyanide Product via C–H Bond Activation under Mild Co…

2012

Reaction of the diarylgermylene Ge(Ar(Me(6)))(2) [Ar(Me(6)) = C(6)H(3)-2,6-(C(6)H(2)-2,4,6-(CH(3))(3))(2)] with tert-butyl isocyanide gave the Lewis adduct species (Ar(Me(6)))(2)GeCNBu(t), in which the isocyanide ligand displays a decreased C-N stretching frequency consistent with an n → π* back-bonding interaction. Density functional theory confirmed that the HOMO is a Ge-C bonding combination between the lone pair of electrons on the germanium atom and the C-N π* orbital of the isocyanide ligand. The complex undergoes facile C-H bond activation to produce a new diarylgermanium hydride/cyanide species and isobutene via heterolytic cleavage of the N-Bu(t) bond.

Models MolecularC h bondCyanidesLigandHydrideGermaniumIsocyanideCyanidechemistry.chemical_elementGermaniumHydrogen BondingGeneral ChemistryPhotochemistryCrystallography X-RayBiochemistryMedicinal chemistryCatalysisAdductchemistry.chemical_compoundColloid and Surface ChemistrychemistryOrganometallic Compoundsta116Pi backbondingHydrogenJournal of the American Chemical Society
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Electrical Bistability around Room Temperature in an Unprecedented One-Dimensional Coordination Magnetic Polymer

2013

The synthesis, crystal structure, and physical properties of an unprecedented one-dimensional (1D) coordination polymer containing [Fe2(S2C6H2Cl2)4](2-) entities bridged by dicationic [K2(μ-H2O)2(THF)4](2+) units are described. The magnetic properties show that the title compound presents pairwise Fe-Fe antiferromagnetic interactions that can be well reproduced with a S = 1/2 dimer model with an exchange coupling, J = -23 cm(-1). The electrical conductivity measurements show that the title compound is a semiconductor with an activation energy of about 290 meV and two different transitions, both with large hysteresis of about 60 and 30 K at 260-320 K and 350-380 K, respectively. These two tr…

Models MolecularCalorimetry Differential ScanningMolecular StructurePolymersCoordination polymerbusiness.industryTemperatureElectronsCrystal structureActivation energyInorganic Chemistrychemistry.chemical_compoundHysteresisCrystallographyMagnetic FieldsDifferential scanning calorimetrySemiconductorchemistryElectrical resistivity and conductivityOrganometallic CompoundsAntiferromagnetismPhysical and Theoretical ChemistrybusinessInorganic Chemistry
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Metamorphosis of a butterfly: synthesis, structural, thermal, magnetic and DFT characterisation of a ferromagnetically coupled tetranuclear copper(ii…

2007

The reaction in water of Cu(OH)(2) with 2,2'-bipyridine (bipy) and (NH(4))(2)HPO(4) in a 4 : 4 : 2 molar ratio under an inert atmosphere leads to the formation of a tetranuclear copper(II) complex of formula {[(H(2)O)(2)Cu(4)(bipy)(4)(mu(4)-PO(4))(2)(mu(2)-OH)] x 0.5 HPO(4) x 15.5 H(2)O}, 1, with butterfly topology. The structure of the tetranuclear core in 1 consists of four crystallographically unique copper(II) ions in approximate square-pyramidal geometry with each coordinated to a bipy ligand and interacting through two mu(4)-O,O',O''-phosphate bridges. Additional bridging between Cu(3) and Cu(4) is provided by a hydroxide ligand, whereas two water molecules cap the Cu(1) and Cu(2) squ…

Models MolecularChemistryLigandInorganic chemistryTemperaturechemistry.chemical_elementChromophoreCrystallography X-RayCopperMagnetic susceptibilityIonInorganic ChemistryMagneticsCrystallographychemistry.chemical_compoundModels ChemicalIntramolecular forceOrganometallic CompoundsMoleculeHydroxideCopperDalton Transactions
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Ferromagnetic Cu(II)4, Co(II)4, and Ni(II)6 azido complexes derived from metal-assisted methanolysis of di-2,6-(2-pyridylcarbonyl)pyridine.

2009

Reaction of copper(II) perchlorate with di-2,6-(2-pyridylcarbonyl)pyridine (pyCOpyCOpy, dpcp) in the presence of sodium azide yields complex [Cu(4)(N(3))(2){pyC(OMe)(O)pyC(OMe)(O)py}(2)(MeOH)(2)](ClO(4)) x 2 MeOH (1 x 2 MeOH), which crystallizes in the monoclinic P2(1)/c space group. Similar reaction of cobalt(II) nitrate yields complex [Co(4)(N(3))(2)(NO(3))(2){pyC(OMe)(O)pyC(OMe)(O)py}(2)] x 0.5 MeOH (2 x 0.5 MeOH) which crystallizes in the monoclinic I2/m space group. Reaction of nickel(II) perchlorate yields complex [Ni(6)(CO(3))(N(3))(6){pyCOpyC(O)(OMe)py}(3)(MeOH)(2)(H(2)O)][Ni(6)(CO(3))(N(3))(6){pyCOpyC(O)(OMe)py}(3) (MeOH)(3)](ClO(4))(2) x 1.8 MeOH (3 x 1.8 MeOH), which crystallizes…

Models MolecularChemistryStereochemistryPyridinesCyclohexane conformationTemperaturechemistry.chemical_elementCobaltCrystallography X-RayMagnetic susceptibilityInorganic ChemistryPerchloratechemistry.chemical_compoundNickelCrystallographyMagneticsDeprotonationCubaneNickelPyridineOrganometallic CompoundsPhysical and Theoretical ChemistryCopperMonoclinic crystal systemInorganic chemistry
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Insertion of a single-molecule magnet inside a ferromagnetic lattice based on a 3D bimetallic oxalate network: Towards molecular analogues of permane…

2014

The insertion of the single-molecule magnet (SMM) [MnIII(salen) (H2O)]2 2+ (salen2-=N,N-ethylenebis- (salicylideneiminate)) into a ferromagnetic bimetallic oxalate network affords the hybrid compound [MnIII(salen)(H2O)] 2[MnIICrIII(ox)3] 2×(CH3OH)×(CH3CN)2 (1). This cationic Mn2 cluster templates the growth of crystals formed by an unusual achiral 3D oxalate network. The magnetic properties of this hybrid magnet are compared with those of the analogous compounds [Mn III(salen)(H2O)]2[ZnIICr III(ox)3]2×(CH3OH) ×(CH3CN)2 (2) and [InIII(sal 2-trien)][MnIICrIII(ox)3] ×(H2O)0.25×(CH3OH) 0.25×(CH3CN)0.25 (3), which are used as reference compounds. In 2 it has been shown that the magnetic isolatio…

Models MolecularChromium02 engineering and technologyCrystallography X-Ray010402 general chemistry01 natural sciencesCatalysisOxalateMagnetizationParamagnetismchemistry.chemical_compoundFerrimagnetismMagnetic propertiesOrganometallic CompoundsSingle-molecule magnetBimetallic stripCluster compoundsOxalatesManganeseChemistryOrganic ChemistryGeneral ChemistryEthylenediamines021001 nanoscience & nanotechnology0104 chemical sciencesX-ray diffractionCrystallographyFerromagnetismMagnetMagnets0210 nano-technology
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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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Cu(II) complexes with a sulfonamide derived from benzoguanamine. Oxidative cleavage of DNA in the presence of H2O2 and ascorbate

2004

Reaction between benzoguanamine (2,4-diamino-6-phenyl-1,3,5-triazine) and 2-mesitylenesulfonyl chloride leads to formation of a sulfonamide able to form two mononuclear Cu(II) complexes with a CuL(2) stoichiometry. The local environment of the metal cation is a distorted octahedron, with two ligands and two solvent molecules; both complexes crystallize in the monoclinic structure, space group P2(1), with Z=2. In the presence of ascorbate/H(2)O(2,) the two complexes significantly cleavage double-strand pUC18 DNA plasmid. Both complexes exhibit more nuclease efficiency that the copper phenantroline complex. From scavenging reactive oxygen studies we conclude that the hydroxyl radical and a si…

Models MolecularDNA damagechemistry.chemical_elementAscorbic AcidCrystallography X-RayCleavage (embryo)PhotochemistryGuanidinesBiochemistryPeroxideMedicinal chemistryInorganic ChemistryMetalchemistry.chemical_compoundOrganometallic CompoundsMoleculechemistry.chemical_classificationSulfonamidesMolecular StructureTriazinesDNAHydrogen PeroxideCopperSulfonamidechemistryvisual_artvisual_art.visual_art_mediumHydroxyl radicalOxidation-ReductionCopperJournal of Inorganic Biochemistry
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