Search results for "hydrogen"

showing 10 items of 4254 documents

(E)-1-(1,3-Benzodioxol-5-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one

2017

The molecule of the title compound C19H18O6, adopts anEconformation about the C=C double bond and the C—C=C—C torsion angle is −179.30 (16)°. The molecule is nearly planar, as indicated by the dihedral angle of 6.99 (6)° between the benzene ring and the benzodioxalane ring. In the crystal, molecules are linkedviaweak C—H...O hydrogen bonds, forming zigzag chains propagating along thebaxis.

chemistry.chemical_classificationcrystal structureDouble bondHydrogen bondCrystal structureDihedral angle010402 general chemistry010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciences0104 chemical sciencesCrystalchemistry.chemical_compoundCrystallographychemistryZigzagbis-chalconeweak C—H...O hydrogen bondslcsh:QD901-999lcsh:CrystallographyPhysics::Chemical PhysicsBenzeneIUCrData
researchProduct

Crystal structure of 2-methyl-1H-imidazol-3-ium aquatrichlorido(oxalato-κ2O,O′)stannate(IV)

2015

N—H⋯O, N—H⋯Cl and O—H⋯O hydrogen bonds between cations and anions in the complex salt (C4H7N2)+[Sn(H2O)Cl3(C2O4)]− are responsible for the formation of a three-dimensional network structure.

chemistry.chemical_classificationcrystal structureStannateLigandHydrogen bondorganotin(IV) complexInorganic chemistrychemistry.chemical_elementSalt (chemistry)General ChemistryCrystal structureCondensed Matter PhysicsMedicinal chemistryOxalateResearch Communicationslcsh:Chemistrychemistry.chemical_compoundchemistrylcsh:QD1-999hydrogen bondsGeneral Materials ScienceChelationTinActa Crystallographica Section E: Crystallographic Communications
researchProduct

Crystal structure of 1-hy­droxy-2,2,6,6-tetra­methyl­piperidin-1-ium tri­fluoro­methane­sulfonate

2015

In the cation of the title salt, C9H20NO+·CF3O3S−, the six-membered heterocyclic ring displays a chair conformation. In the crystal, centrosymmetric pairs of cations and anions are linked by N—H...O and O—H...O hydrogen bonds to form rings with aR44(14) graph-set motif.

chemistry.chemical_classificationcrystal structurebiologyHydrogen bondStereochemistryCyclohexane conformationSalt (chemistry)Methane sulfonateGeneral ChemistryCrystal structureCondensed Matter Physicsbiology.organism_classificationRing (chemistry)hydrogen bondingMedicinal chemistryData ReportsCrystallcsh:Chemistrychemistrylcsh:QD1-999triflateTetraammonium saltGeneral Materials ScienceTEMPOActa Crystallographica Section E: Crystallographic Communications
researchProduct

rac-1,1,1,6,6,6-Hexachlorohex-3-yne-2,5-diol hemihydrate

2017

The asymmetric unit of the title compound, C6H4Cl6O2·0.5H2O, contains one molecule of 1,1,1,6,6,6-hexachlorohex-3-yne-2,5-diol and half a water molecule located on a twofold rotation axis. In the crystal, pairs of hexachlorohexynediol molecules form centrosymmetric dimers connectedviapairwise O—H...O hydrogen bonds. These dimers are connected by water molecules, resulting in layers parallel to theabplane.

chemistry.chemical_classificationcrystal structurecentrosymmetric dimer010405 organic chemistryChemistryStereochemistryHydrogen bondHemihydrateDiolAlkynelayer structureCrystal structure010402 general chemistryHEXA01 natural sciences0104 chemical sciencesorganochlorine compoundCrystalCrystallographychemistry.chemical_compoundlcsh:QD901-999alkyneMoleculelcsh:CrystallographyIUCrData
researchProduct

Crystal structure of an epoxysterol: 9α,11α-epoxy-5α-cholest-7-ene-3β,5,6α-triol 3,6-diacetate

2017

The title compound is a polyoxygenated ep­oxy steroid that crystallizes in the P212121 space group.

chemistry.chemical_classificationcrystal structurehydrogen bondCrystallography010405 organic chemistryHydrogen bondGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter PhysicsRing (chemistry)01 natural sciencesResearch Communications0104 chemical sciencesCrystalCrystallographychemistry.chemical_compoundchemistryQD901-999MoleculeGeneral Materials ScienceTriolEne reactionAlkylsteroidsActa Crystallographica Section E Crystallographic Communications
researchProduct

Separation of aromatic aminophosphonic acid enantiomers by capillary electrophoresis with the application of cyclodextrins

2002

The detailed studies concerning capillary electrophoresis separation of aminophosphonic acid enantiomers with various commercially available cyclodextrins are presented. The obtained results show that the separation of these stereoisomers is dependent on pH of background electrolyte, concentration of cyclodextrin as well as on the type of applied chiral selector. The separation mechanism is based on the co-operative effect of hydrogen bond type interactions enhanced by hydrophobic forces and sterical constrains between aminophosphonate and cyclodextrin. With application of elaborated method, enantiomeric baseline or partial separation of 18 alpha-aminophosphonic acids was achieved. This sep…

chemistry.chemical_classificationcyclodextrinsChromatographyaminophosphonic acidsCyclodextrinHydrogen bondOrganic ChemistryOrganophosphonatesElectrophoresis CapillaryStereoisomerismorganophosphorus compoundsGeneral MedicineElectrolyteBiochemistryAnalytical ChemistryHydrophobic effectCapillary electrophoresischemistryAminophosphonatePhase compositionpolycyclic compoundsEnantiomerJournal of Chromatography A
researchProduct

Inhibition of Plant Lactate Dehydrogenase Isoenzymes by Benzoic Acid and Cinnamic Acid Derivatives

1976

Summary Several phenolic compounds such as derivatives of benzoic and cinnamic acid were investigated with respect to their inhibitory effect on potato tuber lactate dehydrogenase isoenzymes. Ki values were determined and it was found that they were in the range of 10−2 M for several benzoic acid derivatives while they were in the range of 10−5 M for several hydroxylated cinnamic acid derivatives such as 3,4-dihydroxy cinnamic acid, p(m)nitrocinnamic acid, and 7,8-dihydroxy-4-methyl coumarin as well as kynurenic acid. Also coumaric acid derivatives revealed a very strong inhibition: The K1 values for coumarin and p-coumaric acid were in the range of 10−4 M. The inhibition by all aromatic co…

chemistry.chemical_classificationfood and beveragesGeneral MedicineCoumaric acidCoumarinCinnamic acidAmino acidCitric acid cyclechemistry.chemical_compoundKynurenic acidBiochemistrychemistryLactate dehydrogenaseBenzoic acidZeitschrift für Pflanzenphysiologie
researchProduct

Structural Investigation of Water/Lecithin/Cyclohexane Microemulsions by FT-IR Spectroscopy

1995

Abstract FT-IR spectra of water/lecithin/deuterated cyclohexane microemulsions as a function of water/lecithin molar ratio R ( R = [water]/[lecithin]) at various volume fractions ( O ) of the micellar phase have been recorded at 25°C. After elimination of the small spectral contributions due to deuterated cyclohexane and normalization, the shape of the C–H stretching band due to lecithin has been found dependent upon R and O whereas that of the O–H stretching band has been found dependent only upon R . The change in shape of the C–H band was interpreted in terms of a modification of the lecithin alkyl chain packing order. The analysis of the O–H band provides evidence that the hydroxylic gr…

chemistry.chemical_classificationfood.ingredientCyclohexaneHydrogen bondChemistryLecithinSpectral lineSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsBiomaterialschemistry.chemical_compoundColloid and Surface ChemistryfoodDeuteriumPhase (matter)Organic chemistryPhysical chemistryMicroemulsionAlkylJournal of Colloid and Interface Science
researchProduct

Selective recognition of aromatic hydrocarbons by endo-functionalized molecular tubes via C/N-H⋅⋅⋅π interactions

2018

Abstract Molecular recognition of aromatic hydrocarbons by four endo -functionalized molecular tubes has been studied by 1 H NMR spectroscopy, computational methods, and single crystal X-ray crystallography. The binding selectivity is rationalized by invoking shape complementarity and dipole alignment. The non-covalent interactions are proved to predominantly be C/N-H⋅⋅⋅ π interactions.

chemistry.chemical_classificationhydrogen bond010405 organic chemistryHydrogen bondStereochemistrySupramolecular chemistryGeneral Chemistry010402 general chemistry01 natural sciencesmolecular dynamics0104 chemical sciencesMolecular recognitionmacrocycleschemistryhydrogenProton NMRhost-guest chemistryaromatic hydrocarbonhydrocarbonsmolecular recognitionAromatic hydrocarbonSpectroscopyHost–guest chemistryta116Binding selectivityChinese Chemical Letters
researchProduct

Asymmetric hydrogenation of an α-unsaturated carboxylic acid catalyzed by intact chiral transition metal carbonyl clusters – diastereomeric control o…

2020

Twenty clusters of the general formula [(μ-H)2Ru3(μ3-S)(CO)7(μ-P–P*)] (P–P* = chiral diphosphine of the ferrocene-based Walphos or Josiphos families) have been synthesised and characterised. The clusters have been tested as catalysts for asymmetric hydrogenation of tiglic acid [trans-2-methyl-2-butenoic acid]. The observed enantioselectivities and conversion rates strongly support catalysis by intact Ru3 clusters. A catalytic mechanism involving an active Ru3 catalyst generated by CO loss from [(μ-H)2Ru3(μ3-S)(CO)7(μ-P–P*)] has been investigated by DFT calculations. peerReviewed

chemistry.chemical_classificationkarboksyylihapotCarboxylic acidAsymmetric hydrogenationDiastereomerTiglic acidasymmetric hydrogenationMedicinal chemistryCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryFerroceneTransition metalkatalyysicarboxylic acidDalton Transactions
researchProduct