Search results for "force"

showing 10 items of 3423 documents

An intramolecular antiferromagnetically coupled pentanuclear homoleptic Mn(II) cluster: Synthesis, crystal structure, spectral and magnetic property

2013

Abstract A pyrazole based ditopic ligand 5(E)-5-methyl-N′-(pyridin-2-ylmethylene)-1H-pyrazole-3-carbohydrazide (PzOPyH), prepared by the reaction between 5-methylpyrazole-3-carbohydrazide and pyridine-2-carbaldehyde, reacts with Mn(ClO4)2·6H2O to form a self-assembled, antiferromagnetically coupled alkoxide bridged pentanuclear Mn(II) homoleptic cluster complex [Mn5(PzOPy)6](ClO4)4 (1). The complex has a central Mn5(μ-O6) core involving six ligand molecules. This pentanuclear core has a trigonal bipyramidal arrangement of Mn(II) atoms, where, the axial metal centers (Mn2 and Mn_2) have a N3O3 chromophore and the equatorial centers (Mn1, Mn_1 and Mn3) have N4O2 chromophore with distorted oct…

StereochemistryLigandCrystal structureChromophoreInorganic ChemistryTrigonal bipyramidal molecular geometrychemistry.chemical_compoundCrystallographychemistryOctahedronIntramolecular forceMaterials ChemistryMoleculePhysical and Theoretical ChemistryHomolepticPolyhedron
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Synthesis and structure of charge transfer salts of tetrathiafulvalene (TTF) and tetramethyl-TTF with 2,4,7-trinitro and 2,4,5,7-tetranitro-9-fluoren…

2009

Charge transfer salts of tetrathiafulvalene (TTF) and tetramethyltetrathiafulvalene (TMTTF) with the organic acceptors 2,4,7-trinitro-9-fluorenone and 2,4,5,7-tetranitro-9-fluorenone have been prepared and characterized. The compounds (TTF)(TENF) (1), (TTF)3(TRNF)2 (2) and (TMTTF)(TRNF) (3) contain mixed stacks of alternating TTF and nitrofluorenone units. Surprisingly, the degree of charge transfer that occurs in these salts is not controlled solely by the redox potentials of the building blocks, but apparently also by the most effective intermolecular interactions in the solid, as determined from the crystal struc- tures obtained. These three compounds exhibit poor electron delocalization…

StereochemistryMechanical EngineeringIntermolecular forceMetals and AlloysElectron delocalizationCharge (physics)Crystal structureCondensed Matter PhysicsRedoxElectronic Optical and Magnetic MaterialsCrystalchemistry.chemical_compoundCrystallographychemistryMechanics of MaterialsMaterials ChemistryDiamagnetismTetrathiafulvaleneSynthetic Metals
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Four-, five- and six-coordinated Zn-II complexes of OH-containing ligands: Syntheses, structure and reactivity

2002

Four-, five- and six-coordinated complexes of Zn-II with OH-rich molecules possessing an ONO binding core were synthesized, characterized and their structures were established by single-crystal X-ray diffraction, The corresponding metal ion geometries were found to be distorted tetrahedral, square pyramidal and octahedral, respectively. The complexes exhibit interesting lattice structures such as layered and corrugated sheets owing to the presence of a number of weak intermolecular interactions. The five-coordinated, water-bound Zn-II complex was studied because of its putative hydrolysis property towards p-nitrophenyl acetate. (C) Wiley-VCH Verlag GmbH, 69451 Weinheim, Germany, 2002.

StereochemistryMetalloenzymesCrystal structureInorganic ChemistryX-Ray DiffractionCrystal-StructuresElectrochemistryMoleculeReactivity (chemistry)IonMonooxovanadium(V)ChemistryHydrogen bondIntermolecular forceCarbonic-AnhydraseNO LigandsHydrogen BondsSquare pyramidal molecular geometryCrystallographyVanadium(V) ComplexesRecognitionZincZinc EnzymesOctahedronX-ray crystallographyDerivativesModelIndraStra Global
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Diastereoselective Intramolecular Additions of Allyl- and Propargylsilanes to Iminium Ions: Synthesis of Cyclic and Bicyclic Quaternary Amino Acids

2010

Chiral imino lactones derived from (R)-phenylglycinol containing an allyl- or propargyltrimethylsilyl group in the side chain readily cyclized in the presence of acidic reagents to afford spirocyclic compounds with high diastereoselectivity. Removal of the chiral auxiliary produced 2-substituted 1-aminocycloalkanecarboxylic acids, whereas further cyclizations by means of metathesis or hydroamination reactions led to bicyclic derivatives of pipecolic acid and proline.

StereochemistryMetathesisBiochemistrychemistry.chemical_compoundheterocyclic compoundsAmino AcidsPhysical and Theoretical ChemistryPipecolic acidIonschemistry.chemical_classificationChiral auxiliaryMolecular StructureBicyclic moleculeorganic chemicalsOrganic ChemistryIminiumStereoisomerismSilanesAmino acidAllyl CompoundschemistryCyclizationAlkynesIntramolecular forceIminesHydroamination
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N-sulfinyl amines as a nitrogen source in the asymmetric intramolecular aza-Michael reaction: total synthesis of (-)-pinidinol.

2010

N-Sulfinyl amines have been successfully employed as nitrogen nucleophiles for the asymmetric intramolecular aza-Michael reaction. The synthetic strategy involves a cross-metathesis reaction followed by the Michael-type cyclization, either in a base-catalyzed two-step procedure or in a tandem fashion. The developed methodology allows access to chiral substituted pyrrolidines and piperidines bearing one or two stereocenters and it has been applied to the synthesis of the piperidine alkaloid (-)-pinidinol.

StereochemistryNitrogenStereoisomerismMedicinal chemistryCatalysisCatalysisStereocenteraza-Michael reactionchemistry.chemical_compoundNucleophilePiperidinespiperidinesAminesMolecular StructureChemistryOrganic ChemistryTotal synthesispyrrolidinesStereoisomerismGeneral ChemistrysullinylaminesIntramolecular forceSulfoxidesMichael reactioncross metathesisPiperidineChemistry (Weinheim an der Bergstrasse, Germany)
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Adducts of Tellurium Tetrachloride with Allyl Alcohol and Allyl Acetate:  1,2- vs 1,3-Addition and Structure and Dynamics of Te···O Interactions in D…

2002

The compounds Cl 3 Te[CH 2 CH(Cl)CH 2 O(H)...].Cl 2 Te[-CH 2 CH(Cl)CH 2 O-] (1) and Cl 3 Te-[CH 2 CH(CH 2 Cl)OC(CH 3 )=O...] (2) were prepared by the reaction of TeCl 4 with allyl alcohol and allyl acetate, respectively. Their molecular and crystal structures were investigated by single-crystal X-ray analysis, 1 H- 1 H-NOESY experiments, IR spectroscopy, and ab initio geometry optimization. 1 is a composite compound, whose subunits Cl 2 Te[-CH 2 CH(Cl)-CH 2 O-] (1A) and Cl 3 Te[CH 2 CH(Cl)CH 2 O(H))...] (1B) are linked in the solid state via Te...Cl-Te and O...H-O bridges. Both Te atoms are involved in similar five-membered rings, having a covalent Te-O bond in one case (1A) and a dative Te…

StereochemistryOrganic ChemistryAb initioHexacoordinateNuclear magnetic resonance spectroscopyCrystal structureMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundchemistryAllyl acetateIntramolecular forceTellurium tetrachloridePhysical and Theoretical ChemistryAllyl alcoholOrganometallics
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Synthesis and structural studies of 2-stannyl-substituted ferrocenylmethylamine and -phosphine derivatives 2-Me2RSnFcCH2Y (RMe, Cl; YNMe2, PPh2, P(…

1995

Abstract 2-(Trimethylstannyl)ferrocenylmethyldiphenylphosphine, 2-Me3SnFcCH2PPh2 (2a), was synthesized from 2-Me3SnFcCH2NMe2 (1a) and Ph2PH. Compound 2a is oxidized with H2O2 to 2-Me3SnFcCH2P(O)Ph2 (3a). Halogenation of 1a and 2a with Me2SnCl2 and 3a with HCl-diethyl ether yields the organotin monochlorides 2-Me3(Cl)SnFcCH2Y ( 1b , Y = NMe 2 ; 2b , Y = PPh 2 3b , Y = P ( O ) Ph 2 ) . Both crystal structure determinations and multinuclear magnetic resonance studies in solution reveal for 1b–3b molecular structures in which the tin atom approaches a trigonal bipyramidal pentacoordination as a consequence of an intramolecular Y Sn interaction. The donor strength of Y increases in the order PPh2

StereochemistryOrganic ChemistryHalogenationchemistry.chemical_elementEtherCrystal structureBiochemistryMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundTrigonal bipyramidal molecular geometryFerrocenechemistryIntramolecular forceMaterials ChemistryPhysical and Theoretical ChemistryTinPhosphineJournal of Organometallic Chemistry
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Inclusion complexes of Cethyl-2-methylresorcinarene and pyridine N-oxides: breaking the C–I⋯−O–N+ halogen bond by host–guest complexation

2016

C ethyl-2-Methylresorcinarene forms host–guest complexes with aromatic N-oxides through multiple intra- and intermolecular hydrogen bonds and C–H⋯π interactions. The host shows conformational flexibility to accommodate 3-methylpyridine N-oxide, while retaining a crown conformation for 2-methyl- and 4-methoxypyridine N-oxides highlighting the substituent effect of the guest. N-Methylmorpholine N-oxide, a 6-membered ring aliphatic N-oxide with a methyl at the N-oxide nitrogen, is bound by the equatorial −N–CH3 group located deep in the cavity. 2-Iodopyridine N-oxide is the only guest that manifests intermolecular N–O⋯I–C halogen bond interactions, which are broken down by the host resulting i…

StereochemistrySubstituentmacromolecular substancesCrystal structure010402 general chemistryRing (chemistry)01 natural sciencespyridine N-oxideschemistry.chemical_compoundPyridineWATERGeneral Materials ScienceCRYSTAL-STRUCTURESta116Cethyl-2-methylresorcinareneCOORDINATIONHalogen bondPACKINGta114010405 organic chemistryHydrogen bondIntermolecular forceRECOGNITIONGeneral ChemistryETHYL RESORCINARENECondensed Matter PhysicsMETHYLRESORCINARENE0104 chemical sciencesCrystallographySOLID-STATEchemistryhost–guest complexationMETALMOLECULAR CAPSULEShalogen bondSingle crystalCrystEngComm
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Double azido-bridged and mixed-bridged binuclear copper(II) and nickel(II) compounds with N,N,O-donor Schiff bases: Synthesis, structure, magnetic an…

2015

Abstract Two dinuclear complexes μ1,1-azido bridged [Cu(L1)(N3)]2 (1) and μ-phenoxo, μ1,1-azido bridged [Ni2(L2)2(μ1,1-N3)(N3) H2O] (2) bearing HL1 and HL2 as a blocking co-ligands produced by the 1:1 condensation of N-benzyl ethylenediamine with ortho-hydroxy acetophenone and N-methyl propanediamine with 3-methoxy salicylaldehyde respectively, have been synthesized and successfully characterized by elemental analyses, IR and electronic spectroscopy, single-crystal X-ray diffraction, variable temperature magnetic study and DFT studies. X-ray crystal structures of 1 reveal that the Cu(II) ion displays a five-coordinate square pyramidal coordination with a centro-symmetric μ1,1-azido bridging…

Stereochemistrychemistry.chemical_elementEthylenediamineCrystal structureSquare pyramidal molecular geometryInorganic ChemistryMetalchemistry.chemical_compoundCrystallographyNickelSalicylaldehydechemistryIntramolecular forcevisual_artMaterials Chemistryvisual_art.visual_art_mediumPhysical and Theoretical ChemistryAcetophenonePolyhedron
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Self-assembly of 1D- and 3D-networks through non-coordination intermolecular forces: synthesis and crystal structures of copper(I) complexes based on…

2007

Reaction of [Cu2(H3CCN)2(μ-pydz)3][PF6]2 (1) with an excess of pyridazine or phthalazine yielded the novel dinuclear complexes [Cu2(μ-pydz)3(pydz)2][PF6]2 (2) and [Cu2 (μ- pydz)(μ-phtz)2(phtz)2][PF6]2 (5), respectively. Depolymerisation of the coordination polymer 1 ∞ {[Cu(μ-pydz)2][PF6]} (3) in dichloromethane by addition of an excess of benzo[c]cinnoline afforded the dinuclear copper(I) salt [Cu2(μ-pydz)2(pydz)2(benzo[c]cinnoline)2][PF6]2 (4). Furthermore, a new route for the preparation of bis(benzonitrile)tris(μ-phthalazine)dicopper(I) bis(trifluoromethanesulfonate), [Cu2(C6H5CN)2(μ-phtz)3][CF3SO3]2 (7), was established from {[Cu(CF3SO3)]2 ・C6H5Me}, phthalazine and benzonitrile via the …

Stereochemistrychemistry.chemical_elementphthalazineCrystal structure010402 general chemistry01 natural sciencesPyridazinechemistry.chemical_compound[CHIM.COOR]Chemical Sciences/Coordination chemistryCinnolineComputingMilieux_MISCELLANEOUS010405 organic chemistryIntermolecular force[ CHIM.COOR ] Chemical Sciences/Coordination chemistryGeneral Chemistrybenzo[c]cinnolineself-assemblyCopper0104 chemical sciencescopper(I)CrystallographyBenzonitrilepyridazinechemistryPhthalazineTrifluoromethanesulfonate
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