Search results for "Pyrazine"

showing 10 items of 325 documents

Slow relaxation of the magnetization in a {CoIIIMnIII} heterometallic brick-wall network

2021

Abstract The use of the cyanide-bearing dicobalt(III) complex (PPh4)2[Co2III(μ−2,5-dpp)(CN)8] as a metalloligand towards [Mn(salen)(H2O)]ClO4 afforded the heterobimetallic two-dimensional compound of formula [{MnIII(salen)}2{(μ-NC)4Co2III(μ−2,5-dpp)(CN)4}]n (1) [PPh4+ = teraphenylphosphonium cation, 2,5-dpp = 2,5-bis(2-pyridyl)pyrazine and H2salen = N,N’-ethylenebis(salicylideneimine)] whose structure has been determined by single crystal X-ray diffraction. Compound 1 exhibits a neutral brick-wall structure, where each [Co2III(μ−2,5-dpp)(CN)8]2− unit adopts a tetrakis-monodentate bridging mode towards four {MnIII(salen)}+ fragments through four of its eight cyanide ligands. Each cobalt(III)…

Pyrazine010405 organic chemistryChemistryRelaxation (NMR)chemistry.chemical_elementManganese010402 general chemistry01 natural sciences0104 chemical sciencesIonInorganic ChemistryMagnetizationchemistry.chemical_compoundCrystallographyOctahedronMaterials ChemistryMoleculePhysical and Theoretical ChemistrySingle crystalPolyhedron
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Synergetic effect of host-guest chemistry and spin crossover in 3D Hofmann-like metal-organic frameworks [Fe(bpac)M(CN)4] (M=Pt, Pd, Ni).

2012

The synthesis and characterization of a series of three-dimensional (3D) Hofmann-like clathrate porous metal-organic framework (MOF) materials [Fe(bpac)M(CN) 4] (M=Pt, Pd, and Ni; bpac=bis(4-pyridyl)acetylene) that exhibit spin-crossover behavior is reported. The rigid bpac ligand is longer than the previously used azopyridine and pyrazine and has been selected with the aim to improve both the spin-crossover properties and the porosity of the corresponding porous coordination polymers (PCPs). The 3D network is composed of successive {Fe[M(CN) 4]} n planar layers bridged by the bis-monodentate bpac ligand linked in the apical positions of the iron center. The large void between the layers, w…

Pyrazine010405 organic chemistryChemistryStereochemistrymicroporous materialsTransition temperatureOrganic Chemistryhost–guest systemsStackingSpin transitionGeneral Chemistry010402 general chemistry01 natural sciencesCatalysis0104 chemical scienceschemistry.chemical_compoundCrystallographymetal–organic frameworksspin crossoverSpin crossoveradsorptionMoleculeMetal-organic framework[CHIM.COOR]Chemical Sciences/Coordination chemistryHost–guest chemistryChemistry (Weinheim an der Bergstrasse, Germany)
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Spin Crossover in Double Salts Containing Six- and Four-Coordinate Cobalt(II) Ions

2017

The preparation and spectroscopic and structural characterization of three cobalt(II) complexes of formulas [Co(tppz)2](dca)2 (1), [Co(tppz)2][Co(NCS)4]·MeOH (2), and [Co(tppz)2][Co(NCO)4]·2H2O (3) [tppz = 2,3,5,6-tetrakis(2-pyridyl)pyrazine and dca = dicyanamide] are reported here. Compounds 1–3 have in common the presence of the cationic [Co(tppz)2]2+ entity where each mer-tridentate tppz ligand coordinates to the cobalt(II) ion equatorially through two pyridyl donors and axially via the pyrazine, completing the six-coordination. The electroneutrality is achieved by the organic dca group (1) and the anionic tetrakis(thiocyanato-κN)cobaltate(II) (2) and tetrakis(cyanato-κN)cobaltate(II) (3…

Pyrazine010405 organic chemistryLigandStereochemistryCationic polymerizationchemistry.chemical_element010402 general chemistry01 natural sciencesMagnetic susceptibility0104 chemical sciencesIonInorganic Chemistrychemistry.chemical_compoundCrystallographychemistrySpin crossoverPhysical and Theoretical ChemistryCobaltDicyanamideInorganic Chemistry
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High temperature spin crossover in [Fe(pyrazine){Ag(CN) 2 } 2 ] and its solvate

2016

A high temperature spin crossover (Tup = 367 K) was detected in a metal–organic framework [Fe(pz){Ag(CN)2}2]·MeCN (pz = pyrazine). Upon heating, this solvate released acetonitrile guest molecules, which slightly shifted the transition temperature of the complex (Tup = 370 K and Tdown = 356 K).

Pyrazine010405 organic chemistryTransition temperatureGeneral Chemistry010402 general chemistryPhotochemistry01 natural sciencesCatalysis0104 chemical sciences3. Good healthCrystallographychemistry.chemical_compoundchemistrySpin crossoverMaterials ChemistryMoleculeAcetonitrileNew Journal of Chemistry
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A straightforward copper-free palladium methodology for the selective alkynylation of a wide variety of S-, O-, and N-based mono- and diheterocyclic …

2009

Abstract High-yield alkynylations are successfully achieved by a simple and widely accessible catalytic system for an unprecedented variety of heterocyclic bromides and chlorides in position -2, -3 or -5: pyridine, quinoline, thiophene, furan, thiazole, benzothiazole, pyrimidine, pyridazine, pyrazine, dioxepin halides are efficiently functionalized in short time reactions. This copper-free methodology employs 1 mol % palladium only, with inexpensive PPh3 and amine base. The ionic liquid solvent allows a straigtforward separation of products and recycling opportunity. Unsuitable substrates and secondary reactions are also reported in order to point out further progress in cross-coupling usin…

Pyrazine010405 organic chemistry[CHIM.ORGA]Chemical Sciences/Organic chemistryOrganic ChemistryQuinolinechemistry.chemical_element010402 general chemistry01 natural sciencesBiochemistryCombinatorial chemistry0104 chemical sciencesPyridazinechemistry.chemical_compoundchemistryBenzothiazoleHeck alkynylation reaction[ CHIM.ORGA ] Chemical Sciences/Organic chemistryDrug DiscoveryIonic liquidThiopheneThiazoleComputingMilieux_MISCELLANEOUSPalladium
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Positive Allosteric Control of Guests Encapsulation by Metal Binding to Covalent Porphyrin Cages

2018

The allosteric control of the receptor properties of two flexible covalent cages is reported. These receptors consist of two zinc(II) porphyrins connected by four linkers of two different sizes, each incorporating two 1,2,3‐triazolyl ligands. Silver(I) ions act as effectors, responsible for an on/off encapsulation mechanism of neutral guest molecules. Binding silver(I) ions to the triazoles opens the cages and triggers the coordination of pyrazine or the encapsulation of N,N′‐dibutyl‐1,4,5,8‐naphthalene diimide. The X‐ray structure of the silver(I)‐complexed receptor with short connectors is reported, revealing the hollow structure with a cavity well‐defined by two eclipsed porphyrins. Rath…

PyrazineAllosteric regulationSupramolecular chemistryCrystal structure010402 general chemistryporphyrins01 natural sciencessupramolecular chemistryCatalysischemistry.chemical_compoundDiimidesupramolekulaarinen kemiaMoleculeta116010405 organic chemistryallosteric controlOrganic Chemistryhost–guest systemsGeneral ChemistryPorphyrin3. Good health0104 chemical sciencesCrystallographychemistryCovalent bondcage compounds[CHIM.OTHE]Chemical Sciences/Other
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Chains and channels in polynuclear copper(II) complexes with 2,3-bis(2-pyridyl)pyrazine (dpp) as bridging ligand; syntheses, crystal structures and m…

2000

Abstract The preparation and crystal structures for three Cu(II) polynuclear, chain complexes with 2,3-bis(2-pyridyl)pyrazine (dpp) as bridging ligand are reported, [Cu(dpp)(H2O)2]n(NO3)2n·2n/3H2O (1), [Cu(dpp)(H2O)2]n(CF3SO3)2n (2), and [Cu(dpp)(H2O)2]n(BF4)2n·2nH2O (3). For the latter compound the crystal structure at four different temperatures have been studied. Variable-temperature magnetic susceptibility data and ESR measurements of 1–3 and of the related copper(II) chain [Cu(dpp)(H2O)2]n(ClO4)2n·2nH2O (4) (whose structure was previously reported) have been performed. Compounds 1 and 2 crystallize in the same trigonal space group, R 3 c; 3 is orthorhombic, space group Pbca. Complexes …

PyrazineBridging ligandCrystal structureMagnetic susceptibilityInorganic ChemistryCrystallographychemistry.chemical_compoundchemistryOctahedronOctahedral molecular geometryMaterials ChemistryOrthorhombic crystal systemPhysical and Theoretical ChemistryCoordination geometryInorganica Chimica Acta
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Synthesis, spectroscopic (Mössbauer, IR and NMR) and X-ray structural studies of diorganotin complexes of 2,2′-bipyrimidine and further NMR studies o…

1996

Abstract The ligand 2,2′-bipyrimidine (bipym) was reacted with diorganotins R 2 SnCl 2 (R = methyl, ethyl) and complexes of the types R 2 SnCl 2 bipym, R 2 SnCl 2 bipym · bipym and (R 2 SnCl 2 ) 2 bipym were synthesized and studied by 1 H and 13 C NMR spectroscopy in solution, and by IR and Mossbauer spectroscopy in the solid state and frozen solutions. The complexes Et 2 SnCl 2 bipym · bipym and (Et 2 SnCl 2 ) 2 bipym were characterized by X-ray diffraction methods. In both complexes the tin environment is octahedral with chloro atoms in a cis disposition, the ethyl groups in a trans disposition and two N atoms from the ligand bipym. the second complex is a centrosymmetric binuclear specie…

PyrazineChemistryLigandCoordination numberOrganic ChemistryCrystal structureCarbon-13 NMRBiochemistryInorganic ChemistryNMR spectra databasechemistry.chemical_compoundCrystallographyOctahedronMössbauer spectroscopyMaterials ChemistryPhysical and Theoretical ChemistryJournal of Organometallic Chemistry
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Synthesis, spectroscopic studies (Mössbauer and infrared), and the crystal and molecular structure of the organotin(IV)-pyrazine adducts [Sn(CH3)2Cl2…

1987

Two adducts [Sn(CH 3 ) 2 Cl 2 ] 2 pyz ( Ia ) and Sn- (CH 3 ) 2 Br 2 pyz] ( Ib ) (pyz = pyrazine) have been synthesized and characterized in the solid state. Infrared and Mossbauer spectroscopies suggest a five- coordinated species for the Ia complex with an angular CSnC bond and a six-coordinated compound with a linear CSnC bond for the Ib complex. X-ray diffraction studies confirm a distorted trigonal bipyramidal geometry with N, Cl axial atoms and Cl and methyls in the equatorial plane for Ia where the Cl ax SnN bond angle is the lowest one reported to date and the Cl eq Sn bond distance the longest one with regard to similar complexes. This molecule has a short contact of 3.47 A b…

PyrazineChemistryStereochemistryLigandCrystal structureInorganic ChemistryBond lengthCrystallographychemistry.chemical_compoundTrigonal bipyramidal molecular geometryMolecular geometryX-ray crystallographyMaterials ChemistryMoleculePhysical and Theoretical ChemistryInorganica Chimica Acta
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Laser control of the radiationless decay in pyrazine using the dynamic Stark effect

2014

The laser control of the radiationless decay between the B(3u)(nπ*) and B(2u)(ππ*) states of pyrazine using the dynamic Stark effect has been investigated. A vibronic coupling model Hamiltonian in diabatic representation, including potential energy, transition dipole, and static polarizability surfaces as a function of the four most important vibrational modes of the molecule has been parametrized using multi-reference electronic structure calculations. The interaction of the molecule with a strong non-resonant laser pulse has been analyzed in terms of dressed potential energy surfaces. Because of the large polarizability difference between the vibronically coupled B(3u)(nπ*) and B(2u)(ππ*)…

PyrazineChemistryTransition dipole momentGeneral Physics and AstronomyLaserlaw.invention[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistrysymbols.namesakechemistry.chemical_compoundStark effectlawExcited stateLaser coolingQuantum mechanics[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistrysymbolsPhysical and Theoretical ChemistryAtomic physicsComputingMilieux_MISCELLANEOUS
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