Search results for "Proton"

showing 10 items of 5886 documents

Cation-π interactions between neutral calix[5]arene hosts and cationic organic guests

1997

Abstract The binding properties of the 1,3-bridged calix[5]crowns 1–3 towards a number of quaternary ammonium, phosphonium, and iminium ions have been investigated by 1H NMR in CDCl3 solution, where the sole driving force for association is provided by cation-π interactions. We have found that the cavity of a calix[5]arene fixed in a cone-like conformation provides a fairly efficient, but rather unselective, receptor site for quaternary salts. The conformationally mobile p-tert-butylcalix[5]arene (4) is in general a much less efficient binder than the more preorganized calixcrowns, but displays a remarkable selectivity towards N-methylquinuclidinium ion that is believed to arise from a good…

chemistry.chemical_classificationStereochemistryOrganic ChemistryCationic polymerizationIminiumBiochemistryIonchemistry.chemical_compoundchemistryDrug DiscoveryPolymer chemistryProton NMRPhosphoniumCounterionSolvent effectsSelectivityTetrahedron
researchProduct

Star-Shaped Push-Pull Compounds Having 1,3,5-Triazine Cores

2006

The 1,3,5-triazines 9–11 having OPV chains in the 2-, 4- and 6-position represent star-shaped compounds which exhibit strong push-pull effects. Their long-wavelength absorption S0 S1 is characterized by an intramolecular charge transfer (ICT) from the dialkylamino group as electron donor D via the conjugated chain to the 1,3,5-triazine core as electron acceptor A. Protonation of the dialkylamino group removes the donor capability, whereas protonation of the 1,3,5-triazine ring enhances the acceptor strength. Thus, the prevailing protonation site has a crucial influence on the push-pull effect and the ICT. The transition energies ΔE (S0 S1) pass through a minimum for the second generation 10…

chemistry.chemical_classificationStereochemistryOrganic ChemistryElectron donorProtonationElectron acceptorConjugated systemRing (chemistry)Acceptorchemistry.chemical_compoundCrystallographychemistry135-TriazineIntramolecular forcePhysical and Theoretical ChemistryEuropean Journal of Organic Chemistry
researchProduct

Asymmetrically substituted calix[4]arenes; A two-dimensional 1H NMR study of a tetraester derivative in the cone-conformation

1991

Abstract Several new chiral calix[4]arenes with three or four different substituents in the p-position have been prepared by fragment condensation. Standard derivatization procedures always led to the formation of mixtures of various conformational isomers from which the derivative in the cone-conformation could be isolated only by preparative HPLC. For a tetraester derivative it was shown by two-dimensional 1H NMR spectroscopy, that due to the different substituents the cone-conformation is strongly distorted. The sodium complex of this tetraester, however, assumes a regular cone-conformation again.

chemistry.chemical_classificationStereochemistryOrganic ChemistryNuclear Overhauser effectNuclear magnetic resonance spectroscopyBiochemistrychemistry.chemical_compoundCrystallographyPolycyclic compoundchemistryDrug DiscoveryProton NMRDerivatizationConformational isomerismDerivative (chemistry)CyclophaneTetrahedron
researchProduct

Copper(ii) and Zn(ii) coordination chemistry of tetraaza[n]cyclophanes

2003

The acid–base behaviour and Zn2+ and Cu2+ metal coordination chemistry of the novel orthocyclophane ligands 2,5,8,11-tetraaza[12]orthocyclophane (L2) and 2,5,9,12-tetraaza[13]orthocyclophane (L3) and metacyclophane 2,5,8,11-tetraaza[12]metacylophane (L1) are studied. Important differences in the chemistry of these compounds are found depending on the substitution of the aromatic ring. The ortho derivatives are much more basic in their first two protonation steps while the metacyclophane presents much larger constants in the third and fourth protonation stages. The crystal structure of the picrate salt of [H2L3]2+ shows an alternate disposition of the protons in the molecule with formation o…

chemistry.chemical_classificationStereochemistryPicrateProtonationGeneral ChemistryCrystal structureRing (chemistry)CatalysisSquare pyramidal molecular geometryCoordination complexchemistry.chemical_compoundCrystallographychemistryMaterials ChemistryMoleculeCoordination geometryNew J. Chem.
researchProduct

Generation of [2×2] Grid Metallosupramolecular Architectures from Preformed Ditopic Bis(acylhydrazone) Ligands and through Component Self‐Assembly

2007

Ditopic bis(acylhydrazone) ligands, derived from the reactions of carbohydrazides with 2-phenylpyrimidine-4,6-dicarbaldehyde and designed for grid formation with octahedrally coordinating transition-metal ions, exhibit a varied coordination chemistry depending upon the degree of their deprotonation. The neutral acylhydrazones are relatively poor ligands and are seemingly involved in multiple, labile complexation equilibria varying with the solvent and the particular metal salt in solution; nevertheless, grid complexes of different forms can be isolated in the solid state. Although only limited study has been made of the singly deprotonated ligands, grid species appear to be much more readil…

chemistry.chemical_classificationStereochemistrySupramolecular chemistrySalt (chemistry)Crystal structureCoordination complexInorganic ChemistryMetalSolventCrystallographyDeprotonationchemistryvisual_artvisual_art.visual_art_mediumSelf-assemblyEuropean Journal of Inorganic Chemistry
researchProduct

Reactivity Towards Acidic Protic Ligands of Cyclopalladated Di‐μ‐hydroxo Complexes

2008

The dinuclear hydroxo complexes [{Pd(μ-OH)(C∧N)}2] [C∧N = 2-(2-pyridyl)phenyl (Phpy) (I), 7,8-benzoquinolyl (Bzq) (II) and 2-(2-oxazolinyl)phenyl (Phox) (III)] react in a 1:2 molar ratio with a wide variety of protic electrophiles H(L∧L) bearing different sets of donor atoms (L∧L = O∧O or O∧N) to give the mononuclear neutral palladium(II) derivatives with the general formula [Pd(L∧L)(C∧N)] [O∧O = salicylaldehydate (sal) (1), acetylacetonate (acac) (2) and benzoylacetonate (bzac) (3); O∧N = N-phenylsalicylaldiminate (N-Phsal) (4), N-p-chlorophenylsalicylaldiminate (N-pClPhsal) (5), 2-pyrrolecarbaldeydate (2-pcal) (6), 8-hydroxyquinolinate (oxin) (7)]. Structural characterisation of complexes…

chemistry.chemical_classificationStereochemistrychemistry.chemical_elementMedicinal chemistryInorganic ChemistryDeprotonationchemistryMolar ratioElectrophileProton NMRAmine gas treatingReactivity (chemistry)DithiocarbamatePalladiumEuropean Journal of Inorganic Chemistry
researchProduct

Structure and Conformational Studies of Aza-Crown 8-Amino-BODIPY Derivatives: Influence of Steric Hindrance on Their Photophysical Properties

2017

Herein, we report the synthesis, X-ray crystal structure and photophysical studies of six new 8-amino-BODIPY derivatives containing crown or azo-crown ether moieties. The influence of steric hindrance, caused by the crown ether, on the planarity of the BODIPY core and its relationship with the fluorescent properties has been established. 1H NMR spectroscopic studies were undertaken to clarify the changes in fluorescence observed in the presence of ZnII.

chemistry.chemical_classificationSteric effectsConformational change010405 organic chemistryChemistryStereochemistryOrganic ChemistryEtherCrystal structure010402 general chemistry01 natural sciencesCrown Compounds0104 chemical scienceschemistry.chemical_compoundstomatognathic systemProton NMRPhysical and Theoretical ChemistryBODIPYCrown etherEuropean Journal of Organic Chemistry
researchProduct

Synthesis of N-methyl alkylaminomethane-1,1-diphosphonic acids and evaluation of their complex-formation abilities towards copper(II)

2015

Abstract A series of N -methyl alkylaminomethane-1,1-diphosphonic acids ( 3a – g ) with a common tertiary nitrogen atom (CH 3 –N–R) bearing linear or branched alkyl, cycloheptyl or phenylalkyl R substituents was synthesized in the reaction of diethylphosphonate with triethyl orthoformate and secondary amine followed by hydrolysis, and by the Eschweiler–Clarke methylation of the alkylaminomethane-1,1-diphosphonic acids with formic acid and formaldehyde. Complex-formation abilities of 3a – g towards copper(II) in solution were studied by means of pH-potentiometry, ESI-MS spectrometry, UV–Vis and EPR methods. Evaluation of stability constants for the Cu(II) complexes of 3a – g has revealed the…

chemistry.chemical_classificationSteric effectsVis spectroscopyFormic acidStereochemistryProtonationpH potentiometryTriethyl orthoformateMedicinal chemistrylaw.inventionInorganic Chemistrychemistry.chemical_compoundchemistrylawMaterials ChemistryElectronic effectCopper(II) complexesAmine gas treatingEPRPhysical and Theoretical ChemistryElectron paramagnetic resonancebisphosphonatesAlkylPolyhedron
researchProduct

A High‐Capacity Negative Electrode for Asymmetric Supercapacitors Based on a PMo 12 Coordination Polymer with Novel Water‐Assisted Proton Channels

2020

The development of a negative electrode for supercapacitors is a critical challenge for the next-generation of energy-storage devices. Herein, two new electrodes formed by the coordination polymers [Ni(itmb)4 (HPMo12 O40 )]·2H2 O (1) and [Zn(itmb)3 (H2 O)(HPMo12 O40 )]·4H2 O (2) (itmb = 1-(imidazo-1-ly)-4-(1,2,4-triazol-1-ylmethyl)benzene), synthesized by a simple hydrothermal method, are described. Compounds 1 and 2 show high capacitances of 477.9 and 890.2 F g-1 , respectively. An asymmetric supercapacitor device assembled using 2 which has novel water-assisted proton channels as negative electrode and active carbon as positive electrode shows ultrahigh energy density and power density of…

chemistry.chemical_classificationSupercapacitorMaterials scienceProtonCoordination polymer02 engineering and technologyGeneral ChemistryPolymer010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesBiomaterialschemistry.chemical_compoundChemical engineeringchemistryElectrodePolyoxometalateGeneral Materials Science0210 nano-technologyBiotechnologyPower densityDiodeSmall
researchProduct

Stereocontrolled solid-phase synthesis of fluorinated partially-modified retropeptides via tandem aza-Michael/enolate-protonation

2003

N-Acylation of Wang resin-bound l-α-amino acids with 2-trifluoromethyl-propenoyl chloride, followed by asymmetric tandem aza-Michael/enolate-protonation by a series of l-α-amino esters and final release from the resin, afforded a representative library of partially-modified retropeptides incorporating a stereodefined trifluoroalanine surrogate. The stereocontrol can be dramatically improved (up to 15:1) by using apolar solvents like carbon tetrachloride and DABCO as base.

chemistry.chemical_classificationTandemBase (chemistry)Organic ChemistryProtonationDABCOBiochemistryMedicinal chemistryChloridechemistry.chemical_compoundSolid-phase synthesischemistryDrug DiscoverymedicineOrganic chemistrymedicine.drugTetrahedron Letters
researchProduct