学科分类
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71 个结果
  • 简介:Thereactionof1-phenyl-3-methyl-4-benzoyl-2,5-dihydro-1H-pyrazol-5-one(PMBP)andmethyldithiocarbazate(mdtc)inmethanolresultsinformationofayellowcrystallinesolid,adductof1-phenyl-3-methyl-4benzoyl-2,5-dihydro-lH-pyrazol-5-oneandmethyldithiocarbazate.Whentheyellowsolidsweredissolvedinamixtureofmethanolandether(1:4),aredcrystal,whichisanoxidationproductoftheformer,wasobtainedbyallowingsolventtoevaporateforafewdaysatroomtemperature.TheX-rayanalysisoftheredcrystalindicatesthatitisanoveldisulfidewithaspecialstructurelikea“U”conformationinthesolidstate.

  • 标签: 晶体结构 亚氨基甲基}二硫化合物 “U”型构造 杂环化合物
  • 简介:Treatmentof4-amino-3-(1-aryl-5-methyl-1,2,3-triazol-4-yl)-5-mercapto-1,2,4-triazoles/2-amino-5-(1-aryl-5-methyl-1,2,3-triazole-4-yl)-1,3,4-thiadiazoleswithbenzaldehyde,acetoneandω-bromoacetophenonewastestedandcompared.ThetitlecompoundsSchiffbases,amides,imidazolo[2,1-b]-1,3,4-thiadiazolesand7H-s-triazolo[3,4-b]-1,3,4-thiadiazineshavebeenconfirmedbyelementalanalyses,^1HNMR,IRandMSspectra.AllthecompoundshavealsobeenscreenedfortheirantibacterialactivitiesagainstB.subtilis,S.aureusandE.coli.

  • 标签: 合成 抗菌活性 4-氨基-3-(1-芳基-5-甲基-1 2 3-三唑-4-基)-1 3 4-噻重氮 衍生物
  • 简介:Thehydrolysisreactionof(±)-2-acetamido-3-hydroxy-1-(4-nitrophenyl)-1-propanone[(±)-1],anintermediateofchloramphenicol,wasstudiedandthreedifferentproductswereobtainedrespectivelyunderdifferentreactionconditions.Theresolutionofhydrolysisproduct(±)-2-amino-3-hydroxy-1-(4-nitrophenyl)-1-propanone[(±)-3]wascarriedout.Aprocessofcrystallization-inducedasymmetrictransformationwasobservedandupto76%oftheopticallypureenantiomerwasobtainedintheresolutionof(±)-3.

  • 标签: Hydrolysis Resolution EPIMERIZATION
  • 简介:SYNTHESISANDANTI-HUMANIMMUNODEFICIENCYVIRUS-(HIV-)ACTIVITYOF9-(2-PHOSPHONYLMETHOXYETHYL)ADENINE()ANDITSREGIOISOMER3-(2-PHO...

  • 标签: HIV-1
  • 简介:Fourteennew1-acyl-5-arylbiuretsweresynthesizedbythereactionofarylureaswithacylisocynantes.Thelatterwasobtainedfromacylchlorideandleadcyanateindichloromethane,usingpyridineascatalyst.Thestructuresofcompounds3a-nwereconfirmedbyIR,1HNMRandMSspectra.

  • 标签: 1-Acyl-5-aryl BIURET acylisocyanate arylurea SYNTHESIS
  • 简介:Thediffusionbehaviorofpolystyrenewithnarrowmolecularweightdistributionat20℃in1,4-dioxanewasinvestigatedbythephotoncorrelationspectroscopy.Thecumulantmethodwasemployedfortheanalysisoftheintensity-intensityautocorrelationfunctionmeasuredoverawiderangeofthescatteringvector.ThediffusioncoefficientDwasdeterminedasthefunctionofconcentrationCinthemolecularweightrangeof3.0×104-1.20×106.Inalowconcentrationrange,DwasfoundtobelinearlydependentonC,whichhasbeenfoundforsomeothersystems.ThedependenceofDonmolecularweightatinfinitedilutioncanbewrittenasanempiricalformulaD0=kDM-γM,theexponentγ(0.576±0.01)isingoodagreementwiththeresultofthescalingtheory.

  • 标签: MOLECULAR DIFFUSION POLYSTYRENE Dynamic LIGHT SCATTERING
  • 简介:Promotedbystannoussalts,1,1,1-trichloro-2,2,2-trifluoroethanereactsreadilywithaliphatic,aromatic,andα,β-unsaturatedaldehydesgivingthecorrespondingalcoholsbearingaCF3CCl2-moietyingoodtoexcellentyields.ThesealcoholsarefartheroxidizedbyJonesreagentgivingthecorrespondingketonesinhighyields.

  • 标签: 1 1-Trichloro-2 2 2-trifluoroethane ALDEHYDES stannous
  • 简介:TheexpansioncoefficientC^D|L|ofCoulombpotential1/jtofmolecularsystemsinhypersphericalharmonicsisderivedindetail,andtheexplicitexpressionisgiven.

  • 标签: 超球面谐波 扩张 分子体系 势能
  • 简介:新carbene钌建筑群,1,3二度(2,6-dimethylphenyl)-4,5-dihydroimidazol-2-ylidene)(PPh3)Cl2-Ru=CHPh,被综合并且为1-hexene的换位用作催化剂。产生建筑群展出了其TOF直到6680h的很高催化的活动?1。然而,同时重要的石蜡异构化被观察并且能是由改变反应条件的surpressed,例如温度,时间,alkene/Ru臼齿的比率和溶剂。

  • 标签: 烯烃易位作用 异构化作用 卡宾钌催化剂 1-己烯
  • 简介:Newphosphorus-andselenium-containingheterocyclyes,1,3,2,6-dioxaphosphaselena-cyclooctanes(la-1h),weresynthesizedbythereactionofbis(2-hydroxyethyl)selenidewithRP(X)Cl2whereR=alkoxyl,aroxyl,arylandX=Oorlonepair.Theirstructuresweredeterminedbyspectro-scopiesandelementalanalysesandfinallyconfirmedbytheX-raycrystallographicanalysisof1c.Themolecularstructuresoftheheterocycleswerediscussedintermofconformationalanalysis.

  • 标签: HETEROCYCLES SYNTHESIS STRUCTURE
  • 简介:Thetitlecomplex,[La(baec)1/2(H2btec)1/2(H2O)]n(H4btec=1,2,4,5-benzenetetracarboxylicacid)(1)wassynthesizedbythehydrothermalreactionof1,2,4,5-benzenetetracarboxylicdianhydridewithLa(NO3)3·6H2OinH2O,andcrystallizesinthetriclinicsystem,spacegroupP-1withα=0.64403(3)nm,b=0.94500(4)nm,c=0.96380(5)nm,α=88.535(2)°,β=100.314(2)°,γ=76.6470(10)°,V=1.69968(10)nm^3,Z=2,andfinalR=0.0274,Rw=0.0735.In1,eachLa(Ⅲ)ioniscoordinatedbyeightoxygenatomsfromsixcarboxylategroupsandonecoordinatedwatermolecule.TwodifferentcoordinstionmodesofH4btecwerePresentinthestructure,oneofwhichcontainstwoprotonatedcarboxylategrougpstobalancethecharge.

  • 标签: 水热合成 镧配合物 结构 1 2 4 5-苯四羧酸
  • 简介:Twoseriesofnovelcompoundsdesignedashybridsof1-arylnaphthalenelignanswithdihydroisoquinolinesorisoquinolinesweresynthesizedandevaluatedfortheircytotoxicitiesonhumantumorcelllines,suchasA549,Hela,PC-3andKB.SomeofthesyntheticcompoundsexhibitedtheirIC50valuesonselectedcelllinesatμmol/Lscale.

  • 标签: 异喹啉 衍生物 细胞毒素 合成方法 分子结构
  • 简介:Using2-bromo-1-methylpyridimiumiodideascarboxylactivatingagent,10ansa-macrolactamswerepreparedconvenientlyfromthecorrespondingseco-precursorw-aminoacidsintheyieldsof78-2%.

  • 标签: LACTAM ansa-macrolactam CYCLIZATION lactamization.
  • 简介:1,2-rearrangementsofcarbenes:CCH2X(X=CH2,NHandO)arestudiedbyusingabinitiogradientmethod.HeteroatomsNandOstabilizethecarbeneanddecreaseitsreactivity,mainlybychangingfrontiermolecularorbitals,butretainthewayofthereaction.ThereactionstartsfromtheattackofthemigratinghydrogenonthecarbenepAOandendswiththeentranceofthehydrogenintothecarbeneσorbital.ReactivitiesareintheorderofX=CH2>NH>O.Thereactionisexothermicorendothermicaccordingtowhethertheproductisa4n+2or4nπelectronmolecule.

  • 标签: membered stabilize reactivity orbital shorter FRONTIER
  • 简介:ThepossiblegeometricalstructuresandrelativestabilitiesofsemiconductormicroclustersGa.P.(n=1-4)werestudiedbyvirtueofdensityfunctionalcalculationswithgeneralizedgradientapproximation(B3LYP).ForthemoststableisomersofGa,,P.(n=1-4)clusters,theelectronicstructure,vibrationalproperties.dipolemoment,polarizabilityandionizationpotentialwereanalyzedbymeansofHF.MP2.CISDandB3LYPmethodswithdifferentbasissets.

  • 标签: 半导体 磷化镓 电子结构 稳定性 偶极矩 振动性能