Search results for "40"

showing 10 items of 17345 documents

2020

Teraryl-based alpha-helix mimetics have resulted in efficient inhibitors of protein-protein interactions (PPIs). Extending the concept to even longer oligoarene systems would allow for the mimicking of even larger interaction sites. We present a highly efficient synthetic modular access to quateraryl alpha-helix mimetics, in which, at first, two phenols undergo electrooxidative dehydrogenative cross-coupling. The resulting 4,4′-biphenol is then activated by conversion to nonaflates, which serve as leaving groups for iterative Pd-catalyzed Suzuki-cross-coupling reactions with suitably substituted pyridine boronic acids. This work, for the first time, demonstrates the synthetic efficiency of …

010405 organic chemistryPeptidomimetic010402 general chemistryElectrosynthesis01 natural sciencesCombinatorial chemistryCatalysis0104 chemical sciencesProtein–protein interactionCatalysischemistry.chemical_compoundchemistryPyridinePhenolsPhysical and Theoretical ChemistryTrifluoromethanesulfonateAlpha helixCatalysts
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Iron( ii ) and cobalt( ii ) complexes based on anionic phenanthroline-imidazolate ligands: reversible single-crystal-to-single-crystal transformations

2018

A series of low-spin FeII and CoII complexes based on phenanthroline-imidazolate (PIMP) ligands are reported. The FeII complex (H9O4)[Fe(PIMP)3]·(C4H10O)2(H2O) (1a) shows reversible crystalline phase transformations to afford two new phases (H9O4)[Fe(PIMP)3]·(H2O) (1b) and (H9O4)[Fe(PIMP)3]·(C8H18O)(C4H10O)(H2O) (1c) by release of diethyl ether and absorption of diethyl/dibutyl ether, respectively. This reversible uptake/release of solvent molecules is a clear example of single-crystal-to-single-crystal transformation involving a discrete metal complex. On the other hand, the corresponding CoII complex (H9O4)[Co(PIMP)3]·(C4H10O)2(H2O)2 (2) does not exhibit similar phase transformations. In …

010405 organic chemistryPhenanthrolinechemistry.chemical_elementGeneral Chemistry010402 general chemistryCondensed Matter Physics01 natural sciences3. Good health0104 chemical sciencesSolventDibutyl etherMetalchemistry.chemical_compoundCrystallographyDeprotonationchemistryvisual_artImidazolatevisual_art.visual_art_medium[CHIM]Chemical SciencesGeneral Materials Science[CHIM.COOR]Chemical Sciences/Coordination chemistryDiethyl etherCobaltComputingMilieux_MISCELLANEOUS
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Electrosynthesis and X‐ray Crystallographic Structure of Zn II meso ‐Triaryltriphenylphosphonium Porphyrin and Structural Comparison with Mg II meso …

2018

010405 organic chemistryPhosphorusX-raychemistry.chemical_elementCrystal structure010402 general chemistryElectrosynthesis01 natural sciencesPorphyrin0104 chemical sciencesInorganic ChemistryCrystallographychemistry.chemical_compoundchemistryEuropean Journal of Inorganic Chemistry
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The hetero-cubane structures of the heavy alkali metal tert-amyloxides [MOCMe2Et]4 (M = K, Rb, Cs)

2018

A series of alkali metal (Li–Cs) alkoxides of tert-pentanol (1,1-dimethylpropan-1-ol) have been prepared by reaction of the corresponding metal with the alcohol in n-hexane or n-heptane. The compounds were purified by vacuum sublimation and crystallised in n-hexane to produce crystals suitable for single-crystal X-ray diffraction studies. The structures of the potassium, rubidium, and caesium compounds revealed tetrameric units with additional intra- and intermolecular interactions between the metal atom and alkoxide methyl groups, increasing with the size of the metal involved.

010405 organic chemistryPotassiumIntermolecular forcechemistry.chemical_element010402 general chemistryAlkali metal01 natural sciences0104 chemical sciencesRubidiumInorganic ChemistryMetalchemistry.chemical_compoundCrystallographychemistryCubaneCaesiumvisual_artAlkoxidevisual_art.visual_art_mediumDalton Transactions
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[Bis(phosphonio)isophosphindolide]silver complexes

1996

The outcome of reactions of bis(phosphonio)isophosphindolide salts 1[X] and 6[X] (X- Cl-, Br-, CF3SO3-) with silver salts AgY (Y- = CF3SO3-, CF3CO2-, CH3CO2-, 1/2 SO4-) depends strongly on the available anions X, Y. If X-, Y- CF3SO3-, both mononuclear and dinuclear silver complexes are formed which exhibit either μ1,μ1(P) or μ2,η1(P) coordination of the cations 1, 6 to one or to both metals. In solution, dynamic equilibria between both types of products and free 1, 6 were detected by 31P-NMR spectroscopy. Mononuclear (4a, 7) and dinuclear (5a, 8) complexes were isolated as solvates with CHCl3 or THF. If X-, Y- = CF3CO2, only equilibrium mixtures between the free ligands and silver complexes…

010405 organic chemistryPrecipitation (chemistry)ChemistryStereochemistryBridging ligand010402 general chemistryMetathesis01 natural sciences0104 chemical sciencesIonInorganic ChemistrySilver saltsCrystallographyMoleculeSpectroscopySingle crystal
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Formation and trapping of the thermodynamically unfavoured inverted-hemicucurbit[6]uril

2019

Amplification of a thermodynamically unfavoured macrocyclic product through the directed shift of the equilibrium between dynamic covalent chemistry library members is difficult to achieve. We show for the first time that during condensation of formaldehyde and cis-N,N'-cyclohexa-1,2-diylurea formation of inverted-cis-cyclohexanohemicucurbit[6]uril (i-cis-cycHC[6]) can be induced at the expense of thermodynamically favoured cis-cyclohexanohemicucurbit[6]uril (cis-cycHC[6]). The formation of i-cis-cycHC[6] is enhanced in low concentration of the templating chloride anion and suppressed in excess of this template. We found that reaction selectivity is governed by the solution-based template-a…

010405 organic chemistryPrecipitation (chemistry)Metals and AlloysDiastereomerGeneral ChemistryTrapping010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialschemistry.chemical_compoundchemistryComputational chemistryYield (chemistry)Materials ChemistryCeramics and CompositesTrifluoroacetic acidDynamic combinatorial chemistrySelectivityBinding affinitiesChemical Communications
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Comparative hydroamination of aniline and substituted anilines with styrene on different zeolites, triflate based catalysts and their physical mixtur…

2014

Abstract Catalytic performances of different zeolites (Beta and mordenites), scandium triflate based catalysts, mesoporous UVM-7 encapsulated scandium triflate and physical mixtures prepared under ultrasound irradiation were evaluated in the hydroamination of aniline and substituted anilines with styrene. The performances of these catalysts were controlled by the type of acidity and strength. Thus, the conversion was mainly controlled by the strength of the acid sites and their accessibility, while the selectivity appeared to be controlled by the Lewis/Bronsted type of acidity. Lewis acid catalysts directed the reactions mainly to the formation of the Markovnikov adducts while Bronsted acid…

010405 organic chemistryProcess Chemistry and TechnologyMarkovnikov's rulechemistry.chemical_element010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesCatalysischemistry.chemical_compoundAnilinechemistryOrganic chemistryScandiumHydroaminationLewis acids and basesBrønsted–Lowry acid–base theoryTrifluoromethanesulfonateApplied Catalysis A: General
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Hierarchical Beta zeolites obtained in concentrated reaction mixtures as catalysts in tetrahydropyranylation of alcohols

2020

Abstract Hierarchical zeolites consisting of Beta nanoparticles (15–40 nm) were obtained via hydrothermal treatment of a concentrated zeolite gel-precursor (H2O/Si = 2.5–14) without utilization of complex SDAs. The proposed approach is based on the formation of a large number of zeolite nuclei under particular crystallization conditions, followed by their agglomeration resulting in the dense packing of the particles preventing their further growth. The micelles of cetyltrimethylammonium bromide (CTAB) can be used to additionally limit the growth of zeolite nanoparticles during hydrothermal treatment of concentrated reaction mixtures. Such deceleration of crystallization promotes the formati…

010405 organic chemistryProcess Chemistry and TechnologyNanoparticle010402 general chemistry01 natural sciencesMicelleCatalysis0104 chemical sciencesCatalysislaw.inventionAmorphous solid[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistrychemistry.chemical_compoundChemical engineeringchemistrylawAluminosilicateBromideCrystallizationZeoliteComputingMilieux_MISCELLANEOUS
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Substitution of the laser borane anti-B18H22 with pyridine: a structural and photophysical study of some unusually structured macropolyhedral boron h…

2018

Reaction of anti-B18H221 with pyridine in neutral solvents gives sparingly soluble B16H18-3',8'-Py23a as the major product (ca. 53%) and B18H20-6',9'-Py22 (ca. 15%) as the minor product, with small quantities of B18H20-8'-Py 4 (ca. 1%) also being formed. The three new compounds 2, 3a and 4 are characterized by single-crystal X-ray diffraction analyses and by multinuclear multiple-resonance NMR spectroscopy. Compound 2 is of ten-vertex nido:ten-vertex arachno two-atoms-in-common architecture, long postulated for a species with borons-only cluster constitution, but previously elusive. Compound 3a is of unprecedented ten-vertex nido:eight-vertex arachno two-atoms-in-common architecture. The si…

010405 organic chemistryQuantum yieldNuclear magnetic resonance spectroscopyBorane010402 general chemistry01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographysymbols.namesakechemistryPyridinesymbolsPicolinevan der Waals forcePhosphorescenceDerivative (chemistry)Dalton Transactions
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On the Rationalization of Formation of Solvates: Experimental and Computational Study of Solid Forms of Several Nitrobenzoic Acid Derivatives

2020

Analysis of crystal structures, molecular properties, interaction strength in solution and computationally generated non-solvated form solid form landscapes of five chloronitrobenzoic acid isomers ...

010405 organic chemistryRationalization (psychology)Interaction strengthGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter Physics01 natural sciences0104 chemical scienceschemistry.chemical_compoundchemistryComputational chemistryNitrobenzoic acidGeneral Materials ScienceCrystal Growth & Design
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