Search results for " Structure"

showing 10 items of 25475 documents

Highly Anisotropic Rhenium(IV) Complexes: New Examples of Mononuclear Single-Molecule Magnets

2013

The rhenium(IV) complex (NBu4)2[ReBr4(ox)] (1) (ox = oxalate and NBu4(+) = tetra-n-butylammonium cation) has been prepared and its crystal structure determined by X-ray diffraction. The structure is made up of discrete [ReBr4(ox)](2-) anions and bulky NBu4(+) cations. Each [ReBr4(ox)](2-) anion is surrounded by six NBu4(+) cations, which preclude any significant intermolecular contact between the anionic entities, the shortest rhenium···rhenium distance being 9.373(1) Å. Variable temperature dc and ac magnetic susceptibility measurements and field-dependent magnetization experiments on polycrystalline samples of 1 reveal the occurrence of highly anisotropic magnetically isolated Re(IV) cent…

010405 organic chemistryRelaxation (NMR)Inorganic chemistrychemistry.chemical_elementGeneral ChemistryCrystal structureRhenium010402 general chemistry01 natural sciencesBiochemistryMagnetic susceptibilityCatalysisOxalate3. Good health0104 chemical sciencesMagnetizationchemistry.chemical_compoundCrystallographyColloid and Surface ChemistrychemistryMolecule[PHYS.COND.CM-SCE]Physics [physics]/Condensed Matter [cond-mat]/Strongly Correlated Electrons [cond-mat.str-el]IsostructuralComputingMilieux_MISCELLANEOUSJournal of the American Chemical Society
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Magnetostructural correlations in CuII−NC−WV linkage: the case of [CuII(diimine)]2+−[WV(CN)8]3− 0D assemblies

2009

International audience; We report on the syntheses, crystal structures, and magnetic properties of two cyano-bridged molecular assemblies: [CuII(phen)3]2{[CuII(phen)2]2[WV(CN)8]2}(ClO4)2·10H2O (phen = 1,10-phenanthroline) (1) and {[CuII(bpy)2]2[WV(CN)8]} {[CuII(bpy)2][WV(CN)8]}·4H2O (bpy = 2,2′-bipyridyl) (2). Compound 1 consists of cyano-bridged [CuII2WV2]2− molecular rectangles and isolated [CuII(phen)3]2+ complexes. The molecular structure of 2 reveals cyano-bridged trinuclear [CuII2WV]+ and dinuclear [CuIIWV]− ions. Magnetic interactions in 1 are interpreted in terms of the model of a tetranuclear moiety consisting of two ferromagnetic CuII−NC−WV units (J1 = +39(4) cm−1) interacting ant…

010405 organic chemistryStereochemistryChemistryCrystal structureCrystal structureMagnetic response[CHIM.MATE]Chemical Sciences/Material chemistry010402 general chemistry01 natural sciencesAntiferromagnetic coupling0104 chemical sciencesIonInorganic ChemistryCrystallographyFerromagnetismTheoryofComputation_ANALYSISOFALGORITHMSANDPROBLEMCOMPLEXITYMagnetic propertiesMoleculeMoietyChemical synthesisPhysical and Theoretical ChemistryCyano bridged molecular assembliesDiimine
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Influence of the solvent and R groups on the structure of (carboranyl)R2PI2 compounds in solution. Crystal structure of the first iodophosphonium sal…

2008

The influence of the electron-donor or electron-acceptor capacity of the R groups (R = (i)Pr, Ph, Et) and the solvent on the molecular geometry in solution of adducts of carboranylphosphanes [(carboranyl)(i)Pr2P, (carboranyl)Ph2P and (carboranyl)Et2P] with I2 in 1 : 1 ratios, has been studied in detail by 31P{1H} and 11B{1H} NMR spectroscopies. The more electron-accepting Ph groups make the (carboranyl)Ph2P less nucleophilic, thus stabilizing the I2 encapsulated neutral biscarboranylphosphane-diiodine adducts in solution, such as (carboranyl)Ph2PI-IPPh2(carboranyl), generating P---I-I---P motifs. Even in a polar solvent, such as EtOH, the arrangement is preserved. The expected basicity of t…

010405 organic chemistryStereochemistryChemistryIonic bondingCrystal structure010402 general chemistry01 natural sciencesMedicinal chemistry0104 chemical sciencesAdductInorganic ChemistrySolventchemistry.chemical_compoundMolecular geometryNucleophileZwitterionReactivity (chemistry)Dalton Transactions
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Structural and metallo selectivity in the assembly of [2 × 2] grid-type metallosupramolecular species: Mechanisms and kinetic control

2011

An unsymmetrical bis(tridentate) ligand LH in which one binding site can be readily deprotonated forms a kinetically inert [Co(III)L(2)](+) complex which can be used as a "corner" species for the "Coupe du Roi" assembly of trans,trans-[Co(2)M(2)L(4)](6+) metallogrids (M = Fe(II), Co(II), Cu(II), Zn(II)). In the mixed Co(III)/Co(II) species, the oxidation states appear to be localised. In solution, the ligand LH forms octacationic, homometallic [2 × 2] grids with the individual labile metal ions Fe(II), Co(II), Cu(II), Zn(II), seemingly as mixtures of all possible isomers arising from the unsymmetrical nature of the ligand. In the solid state, however, [Zn(4)L(4)](CF(3)SO(3))(8)·4CH(3)CN cry…

010405 organic chemistryStereochemistryChemistryLigandMetal ions in aqueous solutionCrystal structure010402 general chemistry01 natural sciencesKinetic control0104 chemical sciencesInorganic ChemistryCrystallographyDeprotonation[CHIM]Chemical SciencesStereoselectivitySelectivityta116TrifluoromethanesulfonateComputingMilieux_MISCELLANEOUS
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Synthesis and solid state structure for a series of poly(1-pyrrolylmethyl)benzene derivatives. Control of the interplaying π–π and C–H⋯π interactions?

2006

The syntheses of new hexa- and 1,2,4,5-tetra-1-pyrrolylmethyl-benzene (1 and 2, respectively) compounds and their crystal structures, along with those for the related disubstituted o-, m- and p-di-1-pyrrolylmethyl-benzene (3–5) derivatives are reported. The arrangements of molecules in the 1-D structure for 2–5 are controlled by the interplay of two different weak interactions: π–π and C–H⋯π (Ph) interactions. The absence of such interactions in the packing of 1 seems to be related to the arrangement of the pyrrolylmethyl arms with respect to the benzene core, which prevents the π cloud of the aromatic ring to be part of any intermolecular interaction. In addition, C–H⋯π (pyrrolyl) interact…

010405 organic chemistryStereochemistryChemistrySolid-stateGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter PhysicsRing (chemistry)HEXA01 natural sciencesSolid state structure0104 chemical sciences3. Good healthCrystallographychemistry.chemical_compoundBenzene derivativesMoleculeGeneral Materials ScienceBenzeneCrystEngComm
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Synthesis, Crystal Structures, and Magnetic Properties of Two Novel Cyanido-Bridged Heterotrimetallic {CuIIMnIICrIII} Complexes

2017

The self-assembly process between the heteroleptic [CrIII(phen)(CN)4]− and [CrIII(ampy)(CN)4]− metalloligands and the heterobimetallic {CuII(valpn)MnII}2+ tecton afforded two heterotrimetallic complexes of formula [{CuII(valpn)MnII(μ-NC)2CrIII(phen)(CN)2}2{(μ-NC)CrIII(phen)(CN)3}2]·2CH3CN (1) and {[CuII(valpn)MnII(μ-NC)2CrIII(ampy)(CN)2]2·2CH3CN}n (2) [phen = 1,10-phenanthroline, ampy = 2-aminomethylpyridine, and H2valpn = 1,3-propanedyilbis(2-iminomethylene-6-methoxyphenol)]. The crystal structure of 1 consists of neutral CuII2MnII2CrIII4 octanuclear units, where two [Cr(phen)(CN)4]− anions act as bis-monodentate ligands through cyanide groups toward two manganese(II) ions from two [CuII(v…

010405 organic chemistryStereochemistryCoordination polymerCyanidechemistry.chemical_elementCrystal structureManganese010402 general chemistry01 natural sciencesCopper0104 chemical sciencesIonInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryPhysical and Theoretical ChemistryInorganic Chemistry
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A two-dimensional coordination polymer constructed from binuclear copper(II) metalloligands and manganese(II) ions: Synthesis, crystal structure and …

2016

Abstract The self-assembly process between the binuclear [Cu2(HL)(L)]− complex and the manganese(II) ion affords a two-dimensional coordination polymer of formula [Mn{Cu2(HL)(L)}2(H2O)2]n (1) (H3L = 3-hydroxyiminomethylsalicylic acid) where parallel ladder-like motifs of defective double cubanes of bis(phenoxo)dicopper(II) units as rods and anti-syn carboxylato bridges as rungs act as ligands towards tetraaqua-manganese(II) entities through the deprotonated oxime groups. The topology of 1 is compared with the one of another compound, [Mn{Cu2(HL)(L)}2(H2O)4]·4H2O·2DMF (1′) which was obtained in different conditions by Okawa et al. (J. Chem. Soc., Dalton Trans. (2001) 3119). Magnetic suscepti…

010405 organic chemistryStereochemistryCoordination polymerchemistry.chemical_elementCrystal structureManganese010402 general chemistryOxime01 natural sciencesMagnetic susceptibilityCopper0104 chemical sciencesIonInorganic Chemistrychemistry.chemical_compoundCrystallographyDeprotonationchemistryMaterials ChemistryPhysical and Theoretical ChemistryInorganica Chimica Acta
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Synthesis, crystal structure and magnetic properties of a cyanide-bridged heterometallic {CoIIMnIII} chain

2017

The assembly reaction between the low-spin [CoII(dmphen)(CN)3]- metalloligand and the [MnIII(salen)(H2O)]+ complex cation yielded the one-dimensional compound {[MnIII(salen)(μ-NC)2CoII(dmphen)(CN)]·2H2O}n (1), which behaves as a ferrimagnetic chain, the intrachain magnetic coupling being J = -1.71(1) cm-1.

010405 organic chemistryStereochemistryCyanideCrystal structure010402 general chemistry01 natural sciencesInductive coupling0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryChain (algebraic topology)FerrimagnetismDalton Transactions
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Molecular materials based upon organic π-donors and magnetic anions

2000

Electrochemical combination of the magnetic dinuclear anion [MM'(C 2 O 4 )(NCS) 8 ] 4- (MM' = CrCr, CrFe) or paramagnetic mononuclear anion [Cr(NCS) 6 ] 3- with the ET organic π-donor (ET = BEDT-TTF = bis(ethylenedithio)tetrathiafulvalene) gives rise to two new series of molecular hybrid salts formulated (ET) 5 [MM'(C 2 O 4 )(NCS) 8 (MM' = CrCr (1), CrFe (2)), (ET) 8 [MM'(C 2 O 4 )(NCS) 8 ] (3), (ET) 5.5 f Cr(NCS) 6 ] (4) and (ET) 5 [(C 2 H 5 ) 4 N] [Cr(NCS) 6 ](THF) (5) (THF = tetrahydrofuran). The crystal structures consist of alternating organic and inorganic layers. The organic part does not produce any detectable effect on the magnetic properties coming from the inorganic sublattice. T…

010405 organic chemistryStereochemistryGeneral Physics and AstronomyCrystal structure010402 general chemistryElectrochemistry01 natural sciencesMagnetic susceptibility0104 chemical sciencesMetalParamagnetismchemistry.chemical_compoundCrystallographychemistryvisual_art[CHIM] Chemical Sciencesvisual_art.visual_art_mediumMolecule[CHIM]Chemical SciencesTetrathiafulvaleneTetrahydrofuran
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Synthesis, crystal structure and magnetic properties of two oxalato-bridged dimetallic trinuclear complexes combined with a polar cation

2010

Two isostructural heterometallic trinuclear oxalato-bridged complexes of formula C(4)[MCr(2)(ox)(6)(H(2)O)(2)]·nH(2)O (C(+) = 4-aminopyridinium; ox(2-) = oxalate dianion; M(2+) = Mn(2+), n = 3, 1; M(2+) = Co(2+), n = 3.25, 2) have been synthesized by using direct self-assembly methods combining C(3)[Cr(ox)(3)] and the chloride salts of the corresponding metal ion. The crystal structures of both compounds have been resolved by single-crystal X-ray diffraction. They crystallize in the C2/c space group [a = 11.5113(15) Å, b = 20.250(3) Å, c = 21.810(4) Å, beta = 100.447(10) degrees, V = 5161.6(3) Å(3), and Z = 4 for 1, and a = 11.4334(16) Å, b = 20.243(2) Å, c = 21.805(3) Å, beta = 101.113(9) …

010405 organic chemistryStereochemistryHydrogen bondCrystal structure010402 general chemistry01 natural sciencesMagnetic susceptibilityOxalate0104 chemical sciencesInorganic ChemistryMetalchemistry.chemical_compoundCrystallographychemistryvisual_artvisual_art.visual_art_mediumMolecule[CHIM]Chemical SciencesPyridiniumIsostructuralComputingMilieux_MISCELLANEOUS
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