Search results for "ion chemistry"

showing 10 items of 254 documents

Organotin(IV) selenate derivatives – Crystal structure of [{(Ph 3 Sn) 2 SeO 4 } ⋅ CH 3 OH] n

2021

Abstract Crystallization of [(Ph3Sn)2SeO4] ⋅ 1.5H2O in methanol leads to the formation of [{(Ph3Sn)2SeO4} ⋅ CH3OH] n (1) which constitutes a new specimen of organotin(IV) selenate derivatives. In the solid state, complex 1 is arranged in polymeric zig-zag chains, composed of alternating Ph3Sn and SeO4 groups. In addition, pendant Ph3Sn ⋅ CH3OH moieties are branched along chains according to a syndiotactic organization and via Sn-O-Se connections. From a supramolecular point of view, intermolecular hydrogen bonds established between the selenate groups (uncoordinated oxygen) and the hydroxyl functions (CH3OH) of the pendant groups link the chains together.

crystal structure010405 organic chemistryMetals and AlloysGeneral ChemistryCrystal structureorganotin(iv)010402 general chemistryCondensed Matter Physics01 natural sciencesSelenate3. Good health0104 chemical scienceschemistry.chemical_compoundCrystallographyChemistrychemistryMaterials Chemistryinorganic chain[CHIM.CRIS]Chemical Sciences/Cristallography[CHIM]Chemical Sciences[CHIM.COOR]Chemical Sciences/Coordination chemistryseleniumsn-o-se moietyQD1-999
researchProduct

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
researchProduct

Ferro- and Antiferromagnetic Interactions in Oxalato-Centered Inverse Hexanuclear and Chain Copper(II) Complexes with Pyrazole Derivatives.

2021

Two novel copper(II) complexes of formulas {[Cu(4-Hmpz)4][Cu(4-Hmpz)2(µ3-ox-κ2O1,O2:κO2′:κO1′)(ClO4)2]}n (1) and {[Cu(3,4,5-Htmpz)4]2[Cu(3,4,5-Htmpz)2(µ3-ox-κ2O1,O2:κO2′:κO1′)(H2O)(ClO4)]2[Cu2(3,4,5-Htmpz)4(µ-ox-κ2O1,O2:κ2O2′,O1′)]}(ClO4)4·6H2O (2) have been obtained by using 4-methyl-1H-pyrazole (4-Hmpz) and 3,4,5-trimethyl-1H-pyrazole (3,4,5-Htmpz) as terminal ligands and oxalate (ox) as the polyatomic inverse coordination center. The crystal structure of 1 consists of perchlorate counteranions and cationic copper(II) chains with alternating bis(pyrazole)(µ3-κ2O1,O2:κO2′:κO1′-oxalato)copper(II) and tetrakis(pyrazole)copper(II) fragments. The crystal structure of 2 is made up of perchlorat…

crystal structurePharmaceutical Sciencechemistry.chemical_elementCrystal structurePyrazoleOxalateArticleAnalytical ChemistryPerchloratechemistry.chemical_compoundQD241-441TheoryofComputation_ANALYSISOFALGORITHMSANDPROBLEMCOMPLEXITYDrug DiscoveryAntiferromagnetismPhysical and Theoretical Chemistrypolynuclear complexesOrganic ChemistryPolyatomic ioninverse coordination chemistryoxalatoCopperpyrazoleCrystallographycoordination polymerschemistryChemistry (miscellaneous)Intramolecular forcecopperMolecular Medicinemagnetic propertiesMolecules (Basel, Switzerland)
researchProduct

Selective formation of a unique diphosphonium-diphosphine from a tetraphosphine double protonation induced by zirconium salts

2008

A mixed ferrocenyl diphosphonium-diphosphine cation, associated with two [ZrCl(5).thf](-) anions, is obtained from a ferrocenyl tetraphosphine, as a unique didentate ionic metalloligand in a perfectly selective reaction induced by ZrCl(4) in THF.

crystal structureZirconiumSelective reaction010405 organic chemistryChemistryprotonationInorganic chemistry[ CHIM.COOR ] Chemical Sciences/Coordination chemistryzirconiumIonic bondingchemistry.chemical_elementProtonationphosphonium010402 general chemistry01 natural sciencesferrocenyl0104 chemical sciences3. Good healthInorganic ChemistryPolymer chemistrypolyphosphine[CHIM.COOR]Chemical Sciences/Coordination chemistryComputingMilieux_MISCELLANEOUSDalton Transactions
researchProduct

Synthesis, spectroscopic study, and crystal structure of a new organotin(IV) selenate derivative

2018

Abstract The polymeric organotin(IV) selenate complex [(Me3Sn)3(SeO4)(OH)]n (1) has been isolated as single crystals from the reaction of [(Me2NH2)2SeO4] and Me3SnCl in methanol. In the solid state, compound 1 was characterized by X-ray diffraction analysis, Fourier transform-infrared spectroscopy, and elemental analysis. 1 crystallizes in the orthorhombic system space group Pbca with a=11.0231(2) Å, b=16.3461(3) Å, c=20.9945(4) Å, α=β=γ=90°, V=3782.89(12) Å3, and Z=8. Its structure can be described as a polymeric zigzag chain based on Me3Sn moieties linked by tridentate selenate anions. Pendant (Me3Sn)2OH groups are also connected to the chain, according to a syndiotactic organization, and…

crystal structurechemistry.chemical_elementCrystal structureorganotin(iv)010402 general chemistry010403 inorganic & nuclear chemistry01 natural sciencesSelenateoxoanionschemistry.chemical_compoundComputational chemistryMaterials Chemistry[CHIM]Chemical Sciences[CHIM.COOR]Chemical Sciences/Coordination chemistryseleniumQD1-999ComputingMilieux_MISCELLANEOUSMetals and AlloysGeneral ChemistryCondensed Matter Physics0104 chemical sciencesChemistrychemistrysn-o-se moietySeleniumDerivative (chemistry)Main Group Metal Chemistry
researchProduct

Firsts lysidinyl- and lysidinium-triphosphines Pd(II) complexes

2010

International audience; The preparation of first lysidinyl-triphosphine ligand (named Triphosline) is described in three steps which are first a Michael type addition of imidazolidine (or lysidine) to diethylvinylphosphonate, second a phosphonate reduction with LiAlH4 and third an anti-Markovnikov radical addition of the primary phosphine to diphenylvinylphosphine. The Triphosline behaves as a tridentate P-coordinating ligand in palladium(II) complexes. The dangling lysidine function is then cleanly and totally alkylated by methyl iodide to lead to a new kind of lysidinium-triphosphine complexes. Subsequent anion exchange with TlPF6 affords the first example of a chloride free lysidinium-tr…

imidazolinechemistry.chemical_elementpalladium complexesAlkylation010402 general chemistry01 natural sciencesimidazoleInorganic Chemistrychemistry.chemical_compoundImidazolidinetriphosphinePolymer chemistryMaterials ChemistryOrganic chemistry[CHIM.COOR]Chemical Sciences/Coordination chemistryPhysical and Theoretical Chemistry010405 organic chemistryLigand[ CHIM.COOR ] Chemical Sciences/Coordination chemistryPhosphonate0104 chemical scienceschemistryLysidinesynthesis of polyphosphinesPhosphinePalladiumMethyl iodidePolyhedron
researchProduct

Equilibrium and structural studies of complexes with a hexadentate ligand containing amide, amine and pyridyl nitrogen donors. Crystal structures of …

2002

A novel potentially hexadentate ligand, 1,8-bis(2-pyridylcarbamoyl)-3,6-diazaoctane (pyctrien) has been synthesised as its tetrahydrochloride salt; its protonation constants and the stability constants of the copper(II) and nickel(II) chelates have been determined by potentiometry. Amide group deprotonation permits the formation of [MLH−1]+ and [MLH−2] species in all cases, whereas the detection of the neutral or the protonated species depends on the nature of the metal ions. The solid complexes of copper, nickel and cobalt with the neutral and the deprotonated ligand have been synthesised and characterised by IR and UV–VIS spectroscopy. The amidic groups are coordinated through the oxygen …

inorganic chemicals010405 organic chemistryLigandInorganic chemistrychemistry.chemical_elementProtonationGeneral Chemistry[CHIM.INOR]Chemical Sciences/Inorganic chemistry010402 general chemistry01 natural sciencesSquare pyramidal molecular geometry0104 chemical scienceschemistry.chemical_compoundNickelCrystallographyDeprotonationchemistryAmidePyridine[CHIM.COOR]Chemical Sciences/Coordination chemistryCobaltComputingMilieux_MISCELLANEOUS
researchProduct

New Insights into the complexation of lead(II) by 1,4,7,10-tetrakis(carbamoylmethyl)-1,4,7,10-tetraazacyclododecane (DOTAM): structural, thermodynami…

2007

The lead(II) coordination properties of the tetrapodal ligand DOTAM [1,4,7,10-tetrakis(carbamoylmethyl)-1,4,7,10-tetraaza-cyclododecane] have been investigated both in the solid state and in solution in order to ascertain the stereoactivity of the lone pair and to rationalize the structural effects of a cyclen-based scaffold on the metal uptake kinetics. The crystal structure of the free base shows that the pendant acetamide groups are not equivalent: two are folded over the macrocycle and maintained by an intramolecular hydrogen bond involving an amide hydrogen atom and a neighboring tertiary amine of the cyclen ring, while the other two are extended and point away from the macrocyclic cav…

leadCoordination sphereTertiary amine010405 organic chemistryChemistryHydrogen bondLigandStereochemistry[ CHIM.COOR ] Chemical Sciences/Coordination chemistry010402 general chemistry01 natural sciences0104 chemical sciences[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistryInorganic Chemistrychemistry.chemical_compoundCrystallographyCyclenAmideIntramolecular force[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistry[CHIM.COOR]Chemical Sciences/Coordination chemistryLone pairDOTAMComputingMilieux_MISCELLANEOUS
researchProduct

Gas-phase ion chemistry of protonated melatonin

2005

The gas-phase ion chemistry of protonated melatonin has been investigated by mass spectrometric (MS) techniques involving chemical ionisation, fast atom bombardment and electrospray ionisation. Either naturally- occurring or collision-induced decomposition e-D derivatives obtained by exchange with D(2)O. The analysis of experimental results allows definite pathways for the formation of the ion at m/z 174 to be assigned and sheds some more light on the overall fragmentation pathways. Experiments on labelled derivatives evidenced H-D scrambling processes during fragmentation

melatonin ESI/MS ESI/MS/MS deuterium labelled compounds ion chemistry scrambling reactions proton affinitySettore CHIM/02 - Chimica Fisica
researchProduct

Radiation sculpured nanogels as platform for novel therapeutic systems

2012

nanomedicine radiation chemistry nanogelsSettore CHIM/07 - Fondamenti Chimici Delle Tecnologie
researchProduct