Search results for "FORCE"

showing 10 items of 3423 documents

A methylenediphosphonate bridged copper(II) tetramer: Synthesis, structural, thermal, and magnetic characterization of [Cu4(H2O)2(phen)4(μ-P2O6CH2)2]…

2019

Abstract A novel tetracopper(II) complex namely, [Cu4(H2O)2(phen)4(μ-P2O6CH2)2]·21H2O (1) was synthesized by using copper(II) chloride, 1,10-phenanthroline (phen), and methylene diphosphonic acid (MDP). The structure of 1 was characterized by single crystal X-ray diffraction and spectroscopy. Compound 1 crystallizes in the triclinic system, P 1 ¯ space group and its crystal structure consists of neutral centrosymmetric tetranuclear copper(II)-methylene diphosphonate units where each peripheral {Cu(phen)(P2O6CH2)}2− fragment adopts the bidentate(Oeq-P-Oeq)/monodentate (Oax) bridging mode towards each of the two inner {Cu(phen)}2+ entities resulting in a “clamshell”-like orientation. The two …

Denticity010405 organic chemistrychemistry.chemical_elementCrystal structureTriclinic crystal system010402 general chemistry01 natural sciencesCopperSquare pyramidal molecular geometry0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryIntramolecular forceMaterials ChemistryMoleculePhysical and Theoretical ChemistryMethylenePolyhedron
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Preparation, crystal structures and magnetic properties of three thiocyanato-bridged copper(II) complexes with 2,2′-biimidazole or 2-(2′-pyridyl)imid…

2009

The synthesis, crystal structures and variable temperature magnetic investigation of three new thiocyanato-bridged copper(II) complexes with 2,2′-biimidazole (H2bim) or 2-(2′-pyridyl)imidazole) (pyim) as coligands, {[Cu(H2bim)2][Cu(H2bim)(NCS)2(SCN)0.6667(NO3)0.3333]2} · 2H2O (1), [Cu(H2bim)(NCS)2]n (2) and [Cu(pyim)(NCS)2]n (3) are reported. Complex 1 contains centrosymmetric trinuclear species where central [Cu(2)(H2biim)2]2+ cations and peripheral [Cu(1)(H2biim)(NCS)2(SCN)]− anions are linked through single end-to-end thiocyanato bridges. Complexes 2 and 3 are made up of neutral zigzag chains of copper(II) ions linked by single (2) and double (3) end-to-end thiocyanato bridges. A bidenta…

DenticityChemistryLigandchemistry.chemical_elementCrystal structureMagnetic susceptibilityCopperInorganic ChemistryCrystallographychemistry.chemical_compoundIntramolecular forceMaterials ChemistryAntiferromagnetismImidazolePhysical and Theoretical ChemistryPolyhedron
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Cu(II) and Cu(I) complexes with 1,2-dithiosquarate as a ligand; from molecular compounds to supramolecular network structures

2008

Abstract Four new complexes of copper(II) and/or copper(I) with 1,2-dtsq as a ligand have been synthesized and characterized by single crystal X-ray diffraction methods, [CuII(terpy)(1,2-dtsq)] (1), [CuII(dmen)(1,2-dtsq)]n (2), {[CuII(dmen)2][CuI(1,2-dtsq)]2}n·2nH2O(3) and {[CuII(men)2][CuI (1,2-dtsq)]2}n·nH2O (4) (1,2-dtsq = 1,2-dithiosquarate, dianion of 3,4-dimercapto-1-cyclobutene-1,2-dione; dmen = N,N-dimethylethylenediamine; men = N-methylethylenediamine, terpy = 2,2′:6,2″-terpyridine). Compound 1 consists of neutral [CuII(terpy)(1,2-dtsq)] mononuclear units which are held together by O⋯H–C and van der Waals interactions. Compound 2 is built of neutral [CuII(dmen)(1,2-dtsq)] entities …

DenticityCoordination sphereChemistryLigandOrganic ChemistrySupramolecular chemistrychemistry.chemical_elementCrystal structureCopperAnalytical ChemistryInorganic Chemistrysymbols.namesakeCrystallographysymbolsvan der Waals forceSingle crystalSpectroscopyJournal of Molecular Structure
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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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Phenylmalonate‐Containing Copper( II ) Complexes: Synthesis, Crystal Structure and Magnetic Properties

2004

Three new copper(II) complexes of formula [Cu(2,2′-bpy)(Phmal)(H2O)]·2H2O (1), [{Cu(2,2′-bpym)(Phmal)}]n (2) and [{Cu(phen)(Phmal)}]n·3nH2O (3) (Phmal = phenylmalonate; 2,2′-bpy = 2,2′-bipyridine; 2,2′-bpym = 2,2′-bipyrimidine; phen = 1,10-phenanthroline) have been prepared and their structures determined by X-ray diffraction techniques. Complex 1 is mononuclear whereas 2 and 3 are uniform chain compounds. The copper atoms in 1−3 are distorted square-pyramidal: two nitrogen atoms from the bidentate nitrogen heterocycle and two carboxylate oxygen atoms from the phenylmalonate ligand build the equatorial plane; the axial position is filled either by a water molecule (1) or a carboxylate oxyge…

DenticityLigandChemistryStereochemistrychemistry.chemical_elementCrystal structureRing (chemistry)CopperInorganic Chemistrychemistry.chemical_compoundCrystallographyIntramolecular forceMoleculeCarboxylateEuropean Journal of Inorganic Chemistry
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Mono- and Binuclear Copper(II) and Nickel(II) Complexes with the 3,6-Bis(picolylamino)-1,2,4,5-Tetrazine Ligand

2021

Four new compounds of formulas [Cu(hfac)2(L)] (1), [Ni(hfac)2(L)] (2), [{Cu(hfac)2}2(µ-L)]·2CH3OH (3) and [{Ni(hfac)2}2(µ-L)]·2CH3CN (4) [Hhfac = hexafluoroacetylacetone and L = 3,6-bis(picolylamino)-1,2,4,5-tetrazine] have been prepared and their structures determined by X-ray diffraction on single crystals. Compounds 1 and 2 are isostructural mononuclear complexes where the metal ions [copper(II) (1) and nickel(II) (2)] are six-coordinated in distorted octahedral MN2O4 surroundings which are built by two bidentate hfac ligands plus another bidentate L molecule. This last ligand coordinates to the metal ions through the nitrogen atoms of the picolylamine fragment. Compounds 3 and 4 are cen…

DenticityMaterials science42Pharmaceutical Sciencechemistry.chemical_element5-tetrazinecrystal structure determination010402 general chemistry01 natural sciencesO.ArticleAnalytical ChemistryM.lcsh:QD241-441Julvechemistry.chemical_compoundTetrazinenickelStetsiukN 1lcsh:Organic chemistryA.Drug DiscoveryLloret[CHIM]Chemical SciencesPhysical and Theoretical ChemistryIsostructural1245-tetrazine010405 organic chemistryLigandHexafluoroacetylacetoneOrganic ChemistryMagnetic susceptibility0104 chemical sciencesNickelCrystallographyAvarvarichemistryChemistry (miscellaneous)F.Intramolecular forcecopperMolecular Medicinemagnetic propertiesnitrogen ligandsEl-Ghayoury
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Mono-, di- and trinuclear 2,3,5,6-tetrakis(2-pyridyl)pyrazine (tppz)-containing copper(II) complexes: syntheses, crystal structures and magnetic prop…

2004

Three new copper(ii) complexes of formula [Cu(tppz)(NCO)(2)].0.4H(2)O (1), [Cu(2)(tppz)Br(4)](2) and [Cu(3)(tppz)(C(5)O(5))(3)(H(2)O)(3)].7H(2)O (3)[tppz = 2,3,5,6-tetrakis(2-pyridyl)pyrazine; C(5)O(5)(2-) = croconate, dianion of 4,5-dihydroxycyclopent-4-ene-1,2,3-trione] have been synthesised and structurally characterized by X-ray diffraction methods. The structure of complex is made up of neutral [Cu(tppz)(NCO)(2)] mononuclear units and uncoordinated water molecules. The mononuclear units are grouped by pairs to give a rather short copper-copper distance of 3.9244(4) angstroms. The structure of complex 1 consists of neutral tppz-bridged [Cu(2)(tppz)Br(4)] dinuclear units, the copper-copp…

DenticityPyrazineChemistryStereochemistryDimerchemistry.chemical_elementCrystal structureCopperInorganic Chemistrychemistry.chemical_compoundCrystallographyIntramolecular forceAntiferromagnetismMoleculeDalton transactions (Cambridge, England : 2003)
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2,2′-Bipyrimidine- and 2,3-bis(2-pyridyl)pyrazine-containing manganese(II) compounds: Structural and magnetic properties

2003

The preparation, crystal structures and magnetic properties of four different manganese(II) compounds of formula [Mn(bipym)Cl2]n·2nH2O (1), [Mn2(dpp)2(H2O)2Cl4]·2H2O (2), [Mn(dpp)(H2O)2]n(ClO4)2n·1.5nH2O (3) and [Mn(dpp)(dca)2]n (4) [bipym = 2,2′-bipyrimidine, dpp = 2,3-bis(2-pyridyl)pyrazine and dca = dicyanamide anion] are reported. Compounds 1 and 3 are uniform chains of six-coordinated manganese(II) ions bridged by bis(bidentate) bipym (1) and dpp (3) ligands with two chloride groups (1) and two water molecules (3) in cis position. The electroneutrality in 3 is achieved by uncoordinated perchlorate anions. The manganese atom in 1 and 3 exhibits a distorted octahedral environment mainly …

DenticityPyrazineInorganic chemistrychemistry.chemical_elementManganeseCrystal structureBite angleInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryIntramolecular forceMoleculeDicyanamide
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Experimental and Computational Study of Unique Tetranuclear µ 3 ‐Chloride and µ‐Phenoxo/Chloro‐Bridged Defective Dicubane Cobalt(II) Clusters

2016

Two tetranuclear CoII clusters [Co4(L)2(µ3-Cl)2Cl2] have been prepared by using multidentate diaminobisphenolate ligands. The solid-state structures of the complexes were determined by single-crystal X-ray diffraction. The cores of the cluster compounds can be defined as a two-vertex-deficient dicubane geometry (pseudo-dicubane). In the central unit, the cobalt(II) cations are linked through phenoxide oxygen (outer bridges) and chloride anions (inner bridges), previously unprecedented in this type of cobalt cluster. The magnetic properties were studied by both experimental and computational methods. By using a combination of techniques, we were able to determine the nature and strength of t…

DenticityStereochemistryChemistrychemistry.chemical_element02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnologycobalt01 natural sciencesChloride0104 chemical sciencesMagnetic exchangeInorganic ChemistryCrystallographyCentral unitIntramolecular forcedensity functional calculationsmedicineCluster (physics)cluster compoundsmagnetic properties0210 nano-technologyta116Cobaltmedicine.drugEuropean Journal of Inorganic Chemistry
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Enhancing the Magnetic Coupling of Oxalato-Bridged ReIV2MII (M = Mn, Co, Ni, and Cu) Trinuclear Complexes via Peripheral Halide Ligand Effects

2011

Four heterotrinuclear Re(IV)(2)M(II) compounds of general formula (NBu(4))(2)[{Re(IV)Br(4)(μ-ox)}(2)M(II)(Him)(2)] [NBu(4)(+) = tetra-n-butylammonium cation, ox = oxalate, Him = imidazole; M = Mn (1), Co (2), Ni (3), and Cu (4)] have been synthesized by using the novel mononuclear complex [Re(IV)Br(4)(ox)](2-) as a ligand toward divalent first-row transition metal ions in the presence of imidazole. Compounds 1-4 are isostructural complexes whose structure contains discrete trinuclear [{Re(IV)Br(4)(μ-ox)}(2)M(II)(Him)(2)](2-) anions and bulky NBu(4)(+) cations. The Re and M atoms are six-coordinated: four peripheral bromo and two oxalate-oxygens (at Re), and two cis-coordinated imidazole mol…

DenticityStereochemistryLigandMagnetic susceptibilityOxalateInorganic ChemistryCrystallographychemistry.chemical_compoundOctahedronchemistryIntramolecular forceImidazolePhysical and Theoretical ChemistryIsostructuralInorganic Chemistry
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