Theoretical Study of the C_(60)O_3 Isomers

WiththepreparationandisolationofC,,O.'moreandmoreattentionwaspaidtotheirstructuresandpropertiest').WooddetectedC,,O.firstwhentheypreparedC,,byvaporizinggraphite").Fromthenon,thelaboratoriesallovertheworldhavepreparedC6,O.byvariousmethodssuchasPhotoxidationt2-4),Electrochemicaloxi-dation[si,Ozonizationt7.83andChemicaladditiont6'12-14iandsoon.Accordingtothefollow-uptheoreticalstudiesforC,,O.,itisindicatedthattherearetwoisomersofC,,O:eithertheoxygenatomislocatedoverthe6/6bondtogeneratethe6/…     

Solid State Synthesis and Structural Characterization of the Compound H_2 [(n-Bu)_4N]_3 [As (SiW_(11)O_(39))]

1INTRODUCTIONThereactionsoftheundecatungstosilicate{SiW,,O,,j'-withmetalornon-metalionshavebeenextensivelyinvestigated"'-Sofar,mostofthesereactionsreportedintheliteraturehavebeenpreparedeither1nsolutionorunderthehydrothermaIcondi-tion.Recently,wehavepreparedMo(W)-Cu(Ag)-Sclustersbysolidstatereac-tionsatlowheatingtemperatures""'.Asanextensionofthisresearch,wereportherewiththesynthesisandcrystalstructureofH,[(n-llu),Nj,[As(SiW,,O,,)j.2EXPERIMENTALThetitlecompoundwasobtainedbyheat…     

Synthesis and Crystal Structure of FeCo_2(CO)_8(μ_3-S)〔P(OCH_2Ph)_3〕

1INTRODUCTIONBytreatingFeCo2(CO),(p,-S)withgroupVligands[L=PPh,,AsPh,,PBus",p(OEt),j,monosubstitutedderivativesFeCo2(CO),(p,-S)(L)havebeenobtained{1'2i.13C-NMRshowedthatthereplacementofCObyagroupVligandinFeCo,(CO),(p,-S)isatonecobaltatominthemonosubstitutedderivativet2).How-ever,thesubstitutedderivativeofFeCo,(CO),(p,-S)withP(OCH,Ph),hasnotbeenreportedanditscrystalstructurehasnotbeendetermined.WehavesynthesizedthetitlecompoundFeCo,(CO),(p,-S)[P(OCH,Ph),jandtestifiedth…     

Synthesis and Crystal Structure of Nd_2Si_2O_7 in Low Temperature Form

1INTRoDUCTIONAmongthesilicates,rareearthdisilicatesarespecialbecausetheyshowexten-sivepolymorphism"~".Theconfigurationof(Si,O,)doubletetrahedraisrelativelyrelatedtoperiodicityoftherareearthelectronicstructures,suchasvariationinionicsizeordiscontinuityinchemicalbondingproperties,andalsousefulfordiscussingthedegreeofd-pffbondinginsilicates.SmolinandShepelevhavesynthesizedhightem-peratureformofNd,Si,O,crystallizedinorthorhombicsystem"'.Werecent1yob-tainedlowtemperatureformofNd,Si,O,,which…     

基于CaBa_2(BO_3)_2中的Ce~(3+)→Tb~(3+)能量传递及光谱特性

采用高温固相法合成了Ce3+,Tb3+掺杂激活的CaBa2(BO3)2荧光粉,并对其发光特性进行了研究。观察到CaBa2(BO3)2中Ce3+对Tb3+发光的敏化现象。在367 nm紫外光激发下,单掺Tb3+时CaBa2(BO3)2不发光。当Ce3+和Tb3+共掺时,出现Tb3+的发射峰,样品发绿光,表明Ce3+对Tb3+的发光有很强的敏化作用。根据Forster-Dexter理论,分析Ce3+和Tb3+的能量传递过程,还证明在CaBa2(BO3)2:Ce3+,Tb3+中Ce3+对Tb3+的能量传递属于共振能量传递。     

Synthesis and Crystal Structure of {(PPh_3)_2CIRuCIRu(PPh_3) B_(10)H_8[OCH(CH_3)_2)]_2}

1INTRODUCTIONAlthoughseveralhundredpolyhedralmetallaboraneshavebeencharacterized,theincidenceofruthenaboranesisparticularlysurprising.(hThefirstpolyhedralruthenaboraneisstructurallytypifiedbythecompound[(PPh,)2RuB,,HS(OEt),j,whichisobtainedin40%yieldsfromthereactionbetweentRuCI,(PPh,),jandcloso-tB,,H,,j'--inCHCI,/EtOH.tZiWithCH,COOH/THFt'iandC,H,COOH/CH,CI,">insteadofCHCI,/EtOH,twocompoundsF{(PPh,)2Ru}~(p-MeCO,)3--(pH)z-{RuB,,H,}jand[(PPh,)2(PhCOO)RuB,,HSCljhav…     

Synthesis and Luminescent Properties of Eu~(3 )-Doped Na_(24)P_2W_(22)O_(83)

TheheteropolytungstateisoneofthemostchallengingprojectsininorganicchemistryduetoitsaPPlicationonsolidstatechemistly,catalysis,biochemistry,separationandanalysis,etcl-4.Inthispaper,thepreparationmethodandluminescencepropertiesofEu' -dopedNanPZW22O83wereinvestigated.Therelationshipbetweentheluminescentpropertiesandcrystalstructurewasdiscussed.ExperimentalThesampleswerepreparedbysolidstatereactionfrommixturesofN'PZO7'10HZO,WOe,NaZWO"ZHzOandEuZO3.Thestoichiometricalmixtureswerecalcined…     

Synthesis and Properties of Three Tris(1,10-phenanthroline) ruthenium (Ⅱ) Derivatives

MThekeymaterials,5-amino-l,10-phenanthrolineandetS-Ru(phew,CI,,werepreparedbythemethodsofreferences"'.Synthesisofla,foandicEquimolaramountsofcorrespondingto-bromo-alkyIacyIohIondewasaddeddropwisetoasuspensionof5-amino-l,10-phenanthrolineandsodiumdicarbonateindryacetonitrilewithstirringatroomtemperatureundernitrogenfor4-6hours.Thentheresultingsolidwasfilteredandwashedbyacetonitrile,5%sodiumbicarbonateaqueoussolutionandwaterinturn.Afterbeingdriedicvacuo,yellowmicrocrystalsla-cwereobtained.Sy…     

铽配合物Tb(2-MBA)_3·2H_2O和Tb(2-MBA)_3 phen的荧光性能研究

以2-甲基苯甲酸(2-MBA)为第一配体、1,10-邻菲罗啉(phen)为第二配体,制备了三元铽配合物Tb(2-MBA)3phen和二元铽配合物Tb(2-MBA)3·2H2O,并利用元素分析、红外光谱、紫外光谱、荧光光谱和荧光寿命对二者的结构与性能进行分析表征。研究结果表明:三元铽配合物Tb(2-MBA)3phen的荧光发射强度要强于二元铽配合物Tb(2-MBA)3·2H2O,而二者的荧光寿命恰好相反,三元铽配合物Tb(2-MBA)3phen的荧光寿命短于二元铽配合物Tb(2-MBA)3·2H2O。热重分析表明Tb(2-MBA)3·2H2O的热分解温度要远高于Tb(2-MBA)3phen。     

Synthesis and Structure of K_6PMo_7V_2W_3O_(40)(H_2O)_(16)

1INTRODUCTIONHeteropolycompoundsareacidsaswellasoxidizingagents"'.Takingadvantageoftheseproperties,heteropolycompoundshavebeenusedascatalystsforvarioussyntheticreaction(bothinhomogeneousandheterogeneoussystems).Hydrationofpropeneinaliquidphasecatalyzedbyheteropolyacidshasbecomeacommercializedprocess.Oxidationofmethacroleinorisobutyricacidtoproducemethacrylicacidisanexampleofindustrialprocessestowhichthesecompoundsareapplied"--'>.Theoxidationpotential(oroxidizingability)decreaseslinearlywi…     

Synthesis and Crystal Structure of Neodymium Complex[Nd (C_(18)H_(20)N_2O_4) (NO_3)_3]

1INTRODUCT1oNMeta1liccomplexesofsomeSchiffbaseshaveantiviraIandfungistaticac-tivies[1-3i.SomeSchiffbasemetalliccomplexeshavecatalyticactivityasenzyme"'.Thisaspectacu1arresearchfield-WehavereportedthesynthesisandcrystalstructureofNd(llI)nitratecomplexwithN,N-disalicyclideneethylenediamineandDMSO(si'HerethetitlecomplexwasobtainedandcharacterizedbyX-raydiffrac-tion'Theligandisdischiffbaseofcondensationfrom2-hydroxyl-3-methoxyben-zoaldehydeandethylenediamine.2EXPERIMENTAL2.1Synthesi…     

A New Tetranuclear Copper(Ⅰ) Complex of Dithiolate Ligand Fused with TTF Moiety

Dithiolatemetalcomplexeshavegeneratedgreatinterestforalongtimeduetoitsuniqueelectronicandmagneticpropertieshave.Recently,anewsystemofdithiolateligands,combinedwiththeTTFmoiety,hasreceivedmuchattentionl.Underhilletal.havereportedonthestrUcturesofadianionicmercurycomplex[Nme412[Hg(C1oH1oS8)8],andlateronaplanarneutralnickelcomplex[Ni(C,,H,,S,),]"'.Strongdrr-pninteractionbetweenthecentralmetalionandtheconjugatedligands,andtherichredoxbehaviorsofthesecomplexesimplyagoodpotentialinitSapplicati…     

Synthesis and Crystal Structure of Dinitratedioxobis(p-methyl Phenyl Butyl Sulfoxide)Uranium(Ⅵ)[UO_2(p-CH_3C_6H_4SOC_4H_9)_2(NO_3)_2]

1INTRODUCTIONTheextractioncapacityofsulfur--containingsulfoxidesiscomparabletoandevengreaterthanthatoftributylphosphate(TBP)asanextractantfortheextractionandseparationofuraniumandthorium.Atthesametime,theradiolyticstabilityofsulfoxidesisbetterthanthatofTBP'1'23,SothesulfoxidecanbeusedpotentiallyforreprocessingofspentTh--Unuclearfuel.Howeverthecrystalstructureofuranylcomplexwithsulfoxideshas'notbeenreportedt3'4'93.Theknowledgeofthemolecularstructureofthetitlecomplexisusefulforinvestigat…     

Thermodynamics of the Dissociation of Carbonic Acid in Mixed Solvent.4. The System of NaHCO_3-Na_2CO_3-NaCl-Ethanol-Water

Theeffectofethanol-watermixtureontheseconddissociationconstantofcarbonicacidwasofinterestnotonlyforbiologistsbutalsoforchefestsandchemicalengineers,becauseitmayprovideusefulinformationinregardtotheidentificationofthenatureofthesesolute-solventinteractionpatternsinbinarysolventsystem"'.ThispaperreportStheseconddissociationconstantsofcarbonicacid,K,,atfivetemperaturesfrom278.15to318.15Kin5,15,25mass%ethanol-water"dxedsolventsdeterminedfrompreciseelnfmeasurementsincell(A)withoutliquidjunction:Pt…     

A New Ionic Trimolybdenum Cluster Compound:〔Mo_3S_7(S_2P(iprO)_2)_3〕〔S_2P(iprO)_2〕

1INTRODUCTIoNInthepastdecades,thechemistryofMo-Sclusterscontaininga[Mo,(p,-S)(p-S,),j corehasbeenstudiedtextensively,andmanysuchkindofcompoundshavebeensynthesized.(1'2'3'4iHowever,fewcompoundscontainingadiscreteclus-tercationhavebeenreported.[5iInthispaper,wereportthesynthesisandstructureofthetitlecompound.Thisisanewexampleoftrimolybdenumclustercontainingadiscreteclustercation.2EXPERIMENTALAllmanipulationwerecarriedoutinair.2.1Synthesis0f[M0,S,(S,P(iprO),),jtS,P(iprO),jAmixture…     

Synthesis and Crystal Structure of Neodymium Heteropolymolybdate Complex Na_4(NH_4)_(10)[Nd_4 Mo_(29)O_(100)(H_2O)_(16)]·34H_2O

1INTRODUCT1ONThestudyofheteropolycomplexeshasbeenstartedmorethanonehundredyearsago.lnthepasttwentyyearstheheteropoly-coinplexesoftungstenandmolyb-denumhavebeenusedinpreparingcatalystfield,biologicalandionexchangemateri-als.Sothesecomplexeshavebeendeeplystudiedandexaminedbynewtechnicalmethodst2~7J.Wehavereportedthesynthesismethodandcrystalstructureoflanthanideele-mentneodymiumheteropolymolybdate(NH4),2H,,tNd'Mo,,O,,,(H,O)1,j.22H,O('i.Inthispaperwereportthesynthesismethodandcrystalstruc…     

Crystal Structure of {(PPh_3)_2RuB_(10)H_8[(CH_3)_2CHO]_2}

1INTRODUCTIONFromreactionsof[RuCl,(PPh,),jwithcloso-[B,,H,,j'-respectivelyinEtOH/CH,Cl,t'i,CH,COOH/THF"'andC,H,COOH/CH,Cl,">solution,itcanbefoundthatbothalcoholandorganicacidcanreplacehydrogenatomsinborane.Further-more,accordingtotheirdifferentreactiontime(3h,1OOhand113hrespectively),wecanknowthatalcoholismoreactivetoreplacehydrogenatomsinborane.NowinordertoconfirmthisrulefurtherweusePhCH(OH)COOH/(CH3)2CHOHsolutioninsteadofabove-mentionedsolutions.Newcompounds(I)and(II…     

Synthesis and Structure of K_3Na_3〔MnMo_9O_(32)〕·6H_2O

1INTRODUCTIONHeteroPOlymolybdatesareknownwithaverywiderangeofmetalionsithetypeandstabilityoftheclustersshowdependenceonboththeheteroatomandPH"'.TheknownheteroPOlymolybdateswhichincludemanganese(1)ormanganese(IV)havebeenreported.Afewofhetercrg-molybdateanionswiththemanganese(IIV)andnickel(IV)formsarecharacterizedandisostructural[2).Thesehigheroxidationstatespecieshavebeenpreparedpreviouslybyoxidationoflower--valentspecieswithPOwerfuloxidant,suchasPeroxydisulfateorPeroxymonosulfurica…     

Eu(OPri)3/Tb(OPri)3共掺杂P(MMA-co-St)

Eu(OPri)3/Tb(OPri)3共掺杂P(MMA-co-St);Eu(OPri)3/Tb(OPri)3;共掺杂;P(MMA-co-St);荧光性能     

配合物[Tb(p-ClBA)_3(phen)]_2的结构和性能(英文)

Terbium p-chlorobenzoate complex with 1,10-phenanthroline, [Tb( p-ClBA)_3phen]_2 (1) has been obtained in the ethanol solution, where p-ClBA=p-chlorobenzoate and phen=1,10-phenanthroline. It crystallizes in the triclinic system, space group P1, a=1.008 1(2) nm, b=1.185 7(2) nm, c=1.431 1(3) nm, α=110.826(4)°, β=96.436(4)°, γ=101.737(4)°, Z=2. The two Tb(Ⅲ) ions are linked by four carboxylate groups through their bidentate bridging modes, forming a dimeric unit with crystallographic inversion center. Each terbium ion has an eight-coordinate geometry with four of the coordination sites occupied by four oxygen atoms from the four bridging carboxylates, respectively, two oxygen atoms from bidentate carboxylate, and the remaining positions occupied by two nitrogen atoms from a 1,10-phenanthroline molecule. The Tb(Ⅲ) ion adopt a distorted square antiprism coordination geometry. The excitation and luminescence data observed at room temperature show that the title complex emits very intensive green fluorescence under ultraviolet light. The result of thermal analysis indicates the complex [Tb(p-ClBA)_3phen]_2 is quite stable to heat. CCDC: 221921.