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101.
Simon Graßl Clémence Hamze Thaddäus J. Koller Prof. Dr. Paul Knochel 《Chemistry (Weinheim an der Bergstrasse, Germany)》2019,25(15):3752-3755
(Hetero)aryl, benzylic, and alkyl zinc halides were thiolated with N-thiophthalimides at 25 °C within 1 h in the presence of 5–10 % Cu(OAc)2 ⋅ H2O to furnish the corresponding polyfunctionalized thioethers in good yields. This electrophilic thiolation was extended to the introduction of trifluoromethylthio (SCF3), thiocyanate (SCN), and selenophenyl (SePh) groups. The utility of this method was shown in a seven-step synthesis of a potent cathepsin D inhibitor in 34 % overall yield. 相似文献
102.
Etienne V. Brouillet Alan R. Kennedy Tobias Krämer Robert E. Mulvey Stuart D. Robertson Alexander Stewart Stephen Towie 《无机化学与普通化学杂志》2020,646(13):726-733
Previous studies of different solvates of 2-methylpyridyllithium (2-picolyllithium) have uncovered electronic structures corresponding to aza-allyl and enamido resonance forms of the metallated pyridine-based compounds. Here, we report the synthesis and characterization of [2-CH2Li(THF)2C5H4N], a new THF solvate. X-ray crystallographic studies reveal a dimeric arrangement featuring a non-planar eight-membered [NCCLi]2 ring, in which the primary cation-anion interaction is between the central Li atom and the C atom of the deprotonated methyl group [length, 2.285(2) Å], suggesting a new carbanionic resonance structure for this 2-picolyllithium series. The significant carbanionic character of [2-CH2Li(THF)2C5H4N] was confirmed by gas-phase DFT calculations [B3LYP/6-311+G(d)] with the calculated electron density interrogated by means of quantum theory of atoms in molecules (QTAIM) and natural bond orbital (NBO) analyses. For comparison these computational analyses were also performed on the literature structures of [2-CH2Li(2-Picoline)C5H4N] and [2-CH2Li(PMDETA)C5H4N]. In a reactivity study, [2-CH2Li(THF)2C5H4N] was found to undergo nucleophilic addition to pyridine to generate dipyridylmethane in a good yield. 相似文献
103.
The modern intracavity laser method has been applied to study electronic spectra of the hafnium monohalides molecules. Results of new investigation of HfF and HfBr molecules are presented: the bands at 589.3, 590.6, and 593.1 nm observed in intracavity laser spectra of HfF4 have been assigned to the bands of HfF or ionized HfF; new molecular constants of the HfBr molecule have been obtained. Spectroscopic studies of HfCl and Hfl molecules are discussed, and the most reliable molecular constants of HfCl, HfBr, and Hfl molecules are recommended. 相似文献
104.
Vladimir A. Potapov Svetlana V. Amosova Boris V. Petrov 《Phosphorus, sulfur, and silicon and the related elements》2013,188(1):587-590
Reactions of dicyanodiselenide, selenenyl chlorides and bromides with acetylenes and some further transformations of obtained products have been studied. 相似文献
105.
The cyclopalladated ferrocenylimine adducts Ia , Ib , Ic were evaluated in the Suzuki cross‐coupling reaction of benzyl halides with arylboronic acids. The tricyclohexylphosphine adduct Ia exhibited highly catalytic activity for the coupling of aryl and heteroaryl boronic acids containing various functional groups with benzylic bromides and chlorides (up to 99% yield), furnishing diarylmethane derivatives with low catalyst loading (1 mol%). It is worth noting that catalyst Ia can be reused eight times without losing its catalytic activity. Copyright © 2012 John Wiley & Sons, Ltd. 相似文献
106.
Carbonyl compounds reacted with stable phosphonium ylides in D2O to give α-deuterated-α,β-unsaturated carbonyl compounds in the same flask. The chemical yield and deuterium incorporation are excellent under our procedure. The fragile group like ozonide was compatible with our reaction condition. 相似文献
107.
Annihilation characteristics are calculated for positrons trapped in clean and impurity decorated vacancy clusters in Au. The positron lifetime depends strongly on the structure of the clusters. In a strongly relaxed vacancy cluster, the lifetime can become smaller than the lifetime in a single vacancy. The substitution of some neighbour atoms of a vacancy cluster by Fe atoms has only a minor effect on the positron lifetimes. 相似文献
108.
D. G. Pettifor 《辐射效应与固体损伤》2013,168(3-4):121-126
The different roles played by the valence s and d electrons in determining the bulk properties of pure transition metals is described. In the light of this the expected behaviour of the inert gas-metal and metal-metal interatomic potentials is discussed. 相似文献
109.
《Physics and Chemistry of Liquids》2012,50(3):175-180
Abstract In this work, new definitions of the normalized temperature and surface tension are proposed which result in a single plot for the surface tension of molten alkali metals. The functional dependence of the reduced surface tension on the reduced temperature can be adequately described by a straight line; the intercept and slope have been obtained using the linear regression approach. The method proposed herein predicts the values of surface tension at various temperatures with an average error of about 5%. 相似文献
110.
Ashok K. S. Chauhan Arun Kumar R. C. Srivastava 《Phosphorus, sulfur, and silicon and the related elements》2013,188(3-4):1057-1062
Abstract Activated tellurium, but not selenium, reacts with para-substituted benzoylmethyl bromides as well as with iodoacetamide at their melting points in absence of a solvent to give bis(p-substituted benzoylmethyl)tellurium dibromides, (p-YC6H4COCH2)2TeBr2, (Y = H, Me, and MeO) and bis(acetamido)tellurium diiodide, (H2NCOCH2)2TeI2, respectively. Quick reduction of (p-YC6H4COCH2)2TeBr2, with sodium metabisulphite in a two-phase system yields crystalline (p-YC6H4COCH2)2Te. These tellurides undergo smooth oxidative addition of halogens, interhalogen ICl or a pseudohalogen (SCN)2. Intramolecular coordination of the carbonyl group in these functionalized diorganotellurium dihalides is evident from IR spectra and shorter Te···O (carbonyl) distances in comparison to the sum of van der Waals radii and completes six coordination around Te atom. Not unexpectedly, therefore, intermolecular secondary bonding effects of the type Te…O, Te···X and X···X are missing in (PhCOCH2)2TeBr2, (p-MeOC6H4COCH2)TeBr2 and (PhCOCH2)2TeI2. Instead, these compounds provide rare examples, among organotellurium compounds, of supramolecular architecture, where C–H···Br and C–H···O hydrogen bonds and π-π (phenyl ring) interactions appear to be the noncovalent intermolecular associative forces that dominate the crystal packing. 相似文献