Search results for "complex"

showing 10 items of 5889 documents

Double-CO32− Centered [CoII5] Wheel and Modeling of Its Magnetic Properties

2010

A high-spin Co(II) cluster with a rare pentagonal molecular structure and formula [Co(5)(CO(3))(2)(bpp)(5)]ClO(4) (1; Hbpp is 2,6-bis(phenyliminomethyl)-4-methylphenolate) has been synthesized and characterized by single-crystal X-ray diffraction. This topology arises from fusing five [Co(2)(bpp)] moieties in a cyclic manner around two CO(3)(2-) central ligands, resulting in propeller-like configuration. The irregular coordination of the carbonate ions to the metal centers results in a combination of coordination numbers (CNs) of the Co(II) ions of five and six. The bulk magnetization of this complicated magnetically exchanged system has been modeled successfully by employing a matrix diago…

crystal structureCoordination numberInorganic chemistrycarbonatesCatalysisIonCoordination complexMetalMagnetizationCluster (physics)Moleculecarbonate ligandschemistry.chemical_classificationOrganic Chemistrycarbonate ligands; carbonates; cobalt; coordination chemistry; density functional calculations; magnetic properties; spin-orbit coupling; crystal structure.General ChemistrySpin–orbit interactioncobaltspin-orbit couplingCrystallographychemistryvisual_artdensity functional calculationscoordination chemistryvisual_art.visual_art_mediummagnetic propertiesChemistry - A European Journal
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Chlorido(2,2′-{[2-(1-methyl-1H-imidazol-2-yl-κN 3)imidazolidine-1,3-diyl-κN]bis(methylene)}bis(1-methyl-1H-imidazole-κN 3))copper(II) perchlorate

2019

In the crystal structure of the title complex, [CuCl(C17H24N8)]ClO4, the copper(II) metal exhibits an N4Cl pentacoordinate environment in a distorted square-pyramidal geometry. Coordination to the metal centre occurs through the three 1-methylimidazole N atoms from the pendant groups, one amine N atom from the imidazolidine moiety and one chlorido anion. Intermolecular interactions take place at two of the 1-methyl-imidazole rings in the form of parallel-displaced π–π stacking interactions forming chains parallel to the a axis. Three O atoms of the perchlorate anion are rotationally disordered between two orientations with occupancies of 0.5.

crystal structureCrystallographyCopper(II) perchlorate010405 organic chemistrychemistry.chemical_elementGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter Physics01 natural sciencesMedicinal chemistryCopper0104 chemical sciencesPerchloratechemistry.chemical_compoundchemistryQD901-999ImidazolidineImidazoleMoietyGeneral Materials Scienceimidazolidine ligandEne reactioncopper complexActa Crystallographica Section E Crystallographic Communications
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Crystal structure of diaqua[5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinato-κ4N]iron(III) diaqua(18-crown-6)potassium bis(trifluoromethanesulfonate)…

2015

In the title compound, [FeIII(C48H36N4O2)(H2O)2][K(C12H24O6)(H2O)2](SO3CF3)2·2C12H24O6, the FeIIIatom is situated on an inversion centre and is octahedrally coordinated by four pyrrole N atoms of the deprotenated 5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinate ligand and two water molecules. The average equatorial Fe—N(pyrrole) bond length [2.043 (6) Å] is consistent with a high-spin (S= 5/2) iron(III) metalloporphyrin derivative. The K+cation, which also lies on an inversion centre, is chelated by the six O atoms of one 18-crown-6 molecule and is additionally coordinated by two water molecules in a distorted hexagonal–bipyramidal geometry. In the crystal, the cations, anions and one non-c…

crystal structureCrystallographytrifluoromethanesulfonateHydrogen bondStereochemistryLigand18-Crown-6Methane sulfonateGeneral ChemistryCrystal structureCondensed Matter PhysicsMedicinal chemistryPorphyrinData ReportsBond lengthiron(III) complex saltchemistry.chemical_compoundchemistryQD901-999General Materials Sciencetri­fluoro­methane­sulfonateporphyrinPyrroleActa Crystallographica Section E Crystallographic Communications
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Crystal structure and Hirshfeld surface analysis of poly[[bis[μ4-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium]…

2021

The complex nickel(II) anion comprises a pseudomacrocyclic hydrazide-based ligand with an L shape. In the crystal, such anions are connected with the potassium cations and the water solvent mol­ecules, forming a three-dimensional polymeric framework, which is stabilized by an extensive system of hydrogen bonds.

crystal structureCyclohexane conformationshape analysischemistry.chemical_elementCrystal structure010402 general chemistryRing (chemistry)01 natural sciencesResearch Communicationspseudomacrocyclic ligandchemistry.chemical_compoundtemplate reactionSHAPE analysisAmidehirshfeld surface analysisHirshfeld surface analysisGeneral Materials ScienceCrystallography010405 organic chemistryHydrogen bondnickel(ii) complexGeneral ChemistryCondensed Matter Physicsnickel(II) complex3. Good health0104 chemical sciencesTemplate reactionNickelCrystallographychemistryQD901-999Hydratehydrazide-based ligand
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On the mechanistic behavior of highly efficient palladium-tetraphosphine catalytic systems for cross-coupling reactions: first spectroscopic and elec…

2008

Electrochemical studies carried out in conjunction with 31P NMR spectroscopy on the palladium(II)/palladium(0) halogeno complexes of the tetraphosphine 1,1′,2,2′-tetrakis(diphenylphosphino)-4,4′-di...

crystal structureDenticityredox reactionoxidative additiontetraphosphinechemistry.chemical_elementmechanism010402 general chemistryElectrochemistryPhotochemistry01 natural sciencesCoupling reactionCatalysisInorganic Chemistry[ CHIM.CATA ] Chemical Sciences/Catalysiscross-coupling reactionsferrocenylpolyphosphine complexesPhysical and Theoretical ChemistryComputingMilieux_MISCELLANEOUSelectrochemical studies010405 organic chemistryChemistryOrganic Chemistry[CHIM.CATA]Chemical Sciences/CatalysispalladiumCombinatorial chemistryOxidative addition0104 chemical sciences3. Good healthcatalytic systemsreaction kinetics31p nmr spectroscopyPalladium
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Crystal structure of bis{μ2-3-(pyridin-2-yl)-5-[(1,2,4-triazol-1-yl)methyl]-1,2,4-triazolato}bis[aquanitratocopper(II)] dihydrate

2016

The title complex is a centrosymmetric dimer with a copper–copper distance of 4.0408 (3) Å. The Cu ions in the dimer are bridged by two triazole rings and oxygen donor ligands from water mol­ecules and nitrate anions in a distorted octa­hedral coordination geometry.

crystal structureDimerTriazoledinuclear copper complexchemistry.chemical_elementCrystal structure010402 general chemistry01 natural sciencesResearch CommunicationsCrystalchemistry.chemical_compound124-triazoleGeneral Materials ScienceCoordination geometryCrystallography010405 organic chemistryHydrogen bond124-TriazoleGeneral ChemistryCondensed Matter PhysicsCopper0104 chemical sciencesCrystallographychemistryQD901-999hydrogen bondsActa Crystallographica Section E: Crystallographic Communications
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Crystal structures of organoplatinum complexes containing alkyleugenoxyacetate and p-chloroaniline

2016

In the title trans-di­chlorido­platinum(II) complexes, the central PtII atom is further coordinated by the p-chloro­aniline N atom and ethyl­enic double bond of alkyl­eugenoxyacetate.

crystal structureDouble bondStereochemistryCrystal structure010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciencesResearch Communicationstrans-dichloridoplatinum(II) complexeslcsh:Chemistry03 medical and health scienceschemistry.chemical_compound0302 clinical medicinep-chloroanilineGeneral Materials ScienceBenzenetrans-di­chlorido­platinum(II) complexesOrganoplatinumCoordination geometrychemistry.chemical_classificationHydrogen bondLigandp-chloro­anilineGeneral ChemistryCondensed Matter Physicshydrogen bonding0104 chemical sciencesCrystallographychemistrylcsh:QD1-999030220 oncology & carcinogenesisActa Crystallographica Section E: Crystallographic Communications
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Crystal structures of two platinum(II) complexes containing ethyl eugenoxyacetate and 2-amino-pyridine.

2017

The synthesis and crystal structures of two platinum(II) complexes containing one or two Cl atoms, an eugenol derivative and 2-amino­pyridine as ligand are described. The central PtII atom displays a distorted square-planar coordination.

crystal structureDouble bondStereochemistryPopulationDihedral angle010402 general chemistry010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciencesResearch Communicationschemistry.chemical_compoundPyridineGeneral Materials Science2-aminopyridineeducationchemistry.chemical_classificationeducation.field_of_studyCrystallographyChemistryHydrogen bondLigandAromaticity2-amino­pyridineGeneral ChemistryCondensed Matter Physics0104 chemical sciencesCrystallographyQD901-999eugenolplatinum(II) complexes
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Crystal structure of chlorido-{4,5-dimeth-oxy-2-[(2,3-η)-2-prop-2-en-1-yl]phenyl-κC (1)}(piperidine-κN)platinum(II) ethanol monosolvate

2014

The title platinum(II) complex shows a trigonal–bipyramidal coordination and inter­molecular C—H⋯Cl, C—H⋯π and (C/O)—H⋯O hydrogen bonds.

crystal structureEthanolChemistryHydrogen bondchemistry.chemical_elementGeneral ChemistryCrystal structuremethyl­eugenolCondensed Matter Physicshydrogen bondingMedicinal chemistryResearch CommunicationsCrystallcsh:Chemistrychemistry.chemical_compoundmethyleugenollcsh:QD1-999General Materials SciencePiperidinePlatinumplatinum(II) complex
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Hexanuclear copper(ii) cage with {Cu3O⋯H⋯OCu3} core supported by a dicompartmental oxime ligand with m-xylyl spacer: synthesis, molecular structure a…

2010

A new dicompartmental dioxime ligand (H(2)L) with m-xylyl spacer between the donor sites has been synthesised by Schiff-base condensation of α,α'-diamino-m-xylene and diacetyl monooxime. The ligand reacts with copper(ii) salts giving rise to hexanuclear tricationic copper(II) cage complexes [Cu(II)(6)(μ(3)-O···H···O-μ(3))L(3)(H(2)O)(6)]X(3) (X = BF(4), 1a; X = ClO(4), 1b). The complexes have been characterised by different analytical and spectroscopic techniques and confirmed the hexanuclear structure even in solution. Single crystal X-ray diffraction studies of both the complexes revealed a very similar core structure with three dicompartmental ligands supporting two triangular Cu(3)O core…

crystal structureHydrogen bondLigandExchange interactionHexanuclear copper complexchemistry.chemical_elementCrystallography X-RayLigandsOximeHexanuclear copper complex; oxime; crystal structureoximeCopperInorganic ChemistryMagneticschemistry.chemical_compoundCrystallographychemistryUnpaired electronOximesOrganometallic CompoundsMoleculeSingle crystalCopperDalton Transactions
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