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Leader 00000nz a2200037n 45 0
001 WKP|Q42850579 (VIAF cluster) (Authority/Source Record)
003 WKP
005 20241221010713.0
008 241221nneanz||abbn n and d
035 ‎‡a (WKP)Q42850579‏
024 ‎‡a 0000-0002-6920-703X‏ ‎‡2 orcid‏
024 ‎‡a 7201902494‏ ‎‡2 scopus‏
035 ‎‡a (OCoLC)Q42850579‏
100 0 ‎‡a باتريشيا بيريز‏ ‎‡9 ar‏
375 ‎‡a 2‏ ‎‡2 iso5218‏
400 0 ‎‡a Patricia Pérez‏ ‎‡c investigadora‏ ‎‡9 ast‏
400 0 ‎‡a Patricia Pérez‏ ‎‡c researcher‏ ‎‡9 en‏
400 0 ‎‡a Patricia Pérez‏ ‎‡c investigadora‏ ‎‡9 es‏
400 0 ‎‡a Patricia Pérez‏ ‎‡c onderzoeker‏ ‎‡9 nl‏
670 ‎‡a Author's A combined experimental and theoretical study of the polar [3 + 2] cycloaddition of electrophilically activated carbonyl ylides with aldehydes and imines‏
670 ‎‡a Author's A comparative analysis of the electrophilicity of organic molecules between the computed IPs and EAs and the HOMO and LUMO energies‏
670 ‎‡a Author's A comparison between theoretical and experimental models of electrophilicity and nucleophilicity‏
670 ‎‡a Author's A computational and conceptual DFT study on the mechanism of hydrogen activation by novel frustrated Lewis pairs‏
670 ‎‡a Author's A condensed-to-atom nucleophilicity index. An application to the director effects on the electrophilic aromatic substitutions‏
670 ‎‡a Author's A density functional theory formulation of the reaction field model of solvent effects‏
670 ‎‡a Author's A DFT analysis of the participation of zwitterionic TACs in polar [3+2] cycloaddition reactions‏
670 ‎‡a Author's A DFT Study of Inter- and Intramolecular Aryne Ene Reactions‏
670 ‎‡a Author's A DFT study of the ionic [2+2] cycloaddition reactions of keteniminium cations with terminal acetylenes‏
670 ‎‡a Author's A further exploration of a nucleophilicity index based on the gas-phase ionization potentials‏
670 ‎‡a Author's A mechanistic study of the participation of azomethine ylides and carbonyl ylides in [3+2] cycloaddition reactions‏
670 ‎‡a Author's A molecular electron density theory study of the [3 + 2] cycloaddition reaction of nitrones with strained allenes‏
670 ‎‡a Author's A molecular electron density theory study of the insertion of CO into frustrated Lewis pair boron-amidines: a [4 + 1] cycloaddition reaction‏
670 ‎‡a Author's A new model for C–C bond formation processes derived from the Molecular Electron Density Theory in the study of the mechanism of [3+2] cycloaddition reactions of carbenoid nitrile ylides with electron-deficient ethylenes‏
670 ‎‡a Author's A quantum chemical topological analysis of the C-C bond formation in organic reactions involving cationic species‏
670 ‎‡a Author's An Analysis of the Regioselectivity of 1,3-Dipolar Cycloaddition Reactions of BenzonitrileN-Oxides Based on Global and Local Electrophilicity and Nucleophilicity Indices‏
670 ‎‡a Author's An MEDT study of the carbenoid-type [3 + 2] cycloaddition reactions of nitrile ylides with electron-deficient chiral oxazolidinones‏
670 ‎‡a Author's An understanding of the electrophilic/nucleophilic behavior of electro-deficient 2,3-disubstituted 1,3-butadienes in polar diels-alder reactions. A density functional theory study‏
670 ‎‡a Author's Applications of the Conceptual Density Functional Theory Indices to Organic Chemistry Reactivity‏
670 ‎‡a Author's Are one-step aromatic nucleophilic substitutions of non-activated benzenes concerted processes?‏
670 ‎‡a Author's Chapter 9 The electrophilicity index in organic chemistry‏
670 ‎‡a Author's Comparison between Experimental and Theoretical Scales of Electrophilicity Based on Reactivity Indexes‏
670 ‎‡a Author's Comparison between experimental and theoretical scales of electrophilicity in benzhydryl cations‏
670 ‎‡a Author's Complementarity of reaction force and electron localization function analyses of asynchronicity in bond formation in Diels–Alder reactions‏
670 ‎‡a Author's Definition of a Nucleophilicity Scale‏
670 ‎‡a Author's Density Functional Theory Study for the Cycloaddition of 1,3-Butadienes with Dimethyl Acetylenedicarboxylate. Polar Stepwise vs Concerted Mechanisms‏
670 ‎‡a Author's Do substituents make any contribution to the formation of systems where the electronic effects seem to be neutralized? The case of the indigo dye formation‏
670 ‎‡a Author's Dual descriptors within the framework of spin-polarized density functional theory‏
670 ‎‡a Author's Effect of the exchange-correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels-Alder reactions: a reaction force constant analysis‏
670 ‎‡a Author's Electronic contributions to the sigma‏
670 ‎‡a Author's Electronic contributions to the sigma(p) parameter of the Hammett equation.‏
670 ‎‡a Author's Empirical Energy−Density Relationships Applied to the Analysis of the Basicity of Strong Organic Superbases‏
670 ‎‡a Author's Exploring Two-State Reactivity Pathways in the Cycloaddition Reactions of Triplet Methylene‏
670 ‎‡a Author's Further relationships between theoretical and experimental models of electrophilicity and nucleophilicity‏
670 ‎‡a Author's Global and Local Electrophilicity Patterns of Diazonium Ions and Their Reactivity toward π-Nucleophiles‏
670 ‎‡a Author's Global and local reactivity indices for electrophilic/nucleophilic free radicals‏
670 ‎‡a Author's Global and local reactivity of N-heterocyclic carbenes with boron and phosphorus atoms: An analysis based on spin polarized density functional framework‏
670 ‎‡a Author's Global and local reactivity of simple substituted nitrenes and phosphinidenes within the spin-polarized density functional theory framework‏
670 ‎‡a Author's Intrinsic electronic reorganization energy in the electron transfer from substituted N,N-dimethylanilines to phthalimide N-oxyl radical‏
670 ‎‡a Author's Intrinsic relative nucleophilicity of indoles‏
670 ‎‡a Author's Intrinsic Relative Scales of Electrophilicity and Nucleophilicity‏
670 ‎‡a Author's Isoelectronic and isolobal O, CH2, CH3+ and BH3 as electron pairs; similarities between molecular and solid-state chemistry‏
670 ‎‡a Author's Isoelectronic and isolobal O, CH2, CH3+and BH3as electron pairs; similarities between molecular and solid-state chemistry‏
670 ‎‡a Author's Nucleophilicity scale for n- and π-nucleophiles‏
670 ‎‡a Author's On the nature of Parr functions to predict the most reactive sites along organic polar reactions‏
670 ‎‡a Author's On the Nucleophilicity of Boryllithium Compounds. A Theoretical Study‏
670 ‎‡a Author's Origin of the synchronicity in bond formation in polar Diels–Alder reactions: an ELF analysis of the reaction between cyclopentadiene and tetracyanoethylene‏
670 ‎‡a Author's Oxygenation of the phenylhalocarbenes. Are they spin-allowed or spin-forbidden reactions?‏
670 ‎‡a Author's Philicity indices within the spin-polarized density-functional theory framework‏
670 ‎‡a Author's Quantitative characterization of the global electrophilicity pattern of some reagents involved in 1,3-dipolar cycloaddition reactions‏
670 ‎‡a Author's Quantitative characterization of the global electrophilicity power of common diene/dienophile pairs in Diels–Alder reactions‏
670 ‎‡a Author's Quantitative Characterization of the Local Electrophilicity of Organic Molecules. Understanding the Regioselectivity on Diels−Alder Reactions‏
670 ‎‡a Author's Reactivity of the carbon–carbon double bond towards nucleophilic additions. A DFT analysis‏
670 ‎‡a Author's Relationship between basicity and nucleophilicity‏
670 ‎‡a Author's Relationship between Superelectrophilicity and the Electrophilicity Index of Isolated Species‏
670 ‎‡a Author's Solvent Effects on Electrophilicity‏
670 ‎‡a Author's Solvent Effects on Global Reactivity Properties for Neutral and Charged Systems Using the Sequential Monte Carlo Quantum Mechanics Model‏
670 ‎‡a Author's Spin-Philicity and Spin-Donicity as Auxiliary Concepts To Quantify Spin-Catalysis Phenomena‏
670 ‎‡a Author's The mechanism of double proton transfer in dimers of uracil and 2-thiouracil--the reaction force perspective.‏
670 ‎‡a Author's The nucleophilicity N index in organic chemistry‏
670 ‎‡a Author's The reaction force constant as an indicator of synchronicity/nonsynchronicity in [4+2] cycloaddition processes‏
670 ‎‡a Author's Theoretical analysis of some substituted imine-enamine tautomerism‏
670 ‎‡a Author's Theoretical Analysis of Substituted Diels - Alder Reagents to Determine the Polar or Non Polar Character of the Reaction‏
670 ‎‡a Author's Theoretical Evaluation of the Global and Local Electrophilicity Patterns of Singlet Carbenes‏
670 ‎‡a Author's Theoretical investigation of the selectivity in intramolecular cyclizations of some 2’–aminochalcones to dihydroquinolin–8–ones and indolin–3–ones‏
670 ‎‡a Author's Understanding C–C bond formation in polar reactions. An ELF analysis of the Friedel–Crafts reaction between indoles and nitroolefins‏
670 ‎‡a Author's Understanding the [2n+2n] reaction mechanism between a carbenoid intermediate and CO2‏
670 ‎‡a Author's Understanding the Bond Formation in Hetero-Diels-Alder Reactions. An ELF Analysis of the Reaction of Nitroethylene with Dimethylvinylamine‏
670 ‎‡a Author's Understanding the carbenoid-type reactivity of nitrile ylides in [3+2] cycloaddition reactions towards electron-deficient ethylenes: a molecular electron density theory study‏
670 ‎‡a Author's Understanding the chemical reactivity of phenylhalocarbene systems: an analysis based on the spin-polarized density functional theory‏
670 ‎‡a Author's Understanding the local reactivity in polar organic reactions through electrophilic and nucleophilic Parr functions‏
670 ‎‡a Author's Understanding the mechanism of non-polar Diels–Alder reactions. A comparative ELF analysis of concerted and stepwise diradical mechanisms‏
670 ‎‡a Author's Understanding the polar mechanism of the ene reaction. A DFT study‏
670 ‎‡a Author's Understanding the Reactivity of Captodative Ethylenes in Polar Cycloaddition Reactions. A Theoretical Study†‏
670 ‎‡a Author's Understanding the regioselectivity in hetero Diels–Alder reactions. An ELF analysis of the reaction between nitrosoethylene and 1-vinylpyrrolidine‏
670 ‎‡a Author's Understanding the thermal dehydrochlorination reaction of 1-chlorohexane. Revealing the driving bonding pattern at the planar catalytic reaction center‏
670 ‎‡a Author's Unveiling the high reactivity of cyclohexynes in [3 + 2] cycloaddition reactions through the molecular electron density theory‏
670 ‎‡a Author's Why Do Five-Membered Heterocyclic Compounds Sometimes Not Participate in Polar Diels–Alder Reactions?‏
670 ‎‡a Author's π-Strain-Induced Electrophilicity in Small Cycloalkynes: A DFT Analysis of the Polar Cycloaddition of Cyclopentyne towards Enol Ethers‏
909 ‎‡a (orcid) 000000026920703x‏ ‎‡9 1‏
909 ‎‡a (scopus) 7201902494‏ ‎‡9 1‏
919 ‎‡a nucleophilicityscalefornandπnucleophiles‏ ‎‡A Nucleophilicity scale for n- and π-nucleophiles‏ ‎‡9 1‏
919 ‎‡a onthenucleophilicityofboryllithiumcompoundsatheoreticalstudy‏ ‎‡A On the Nucleophilicity of Boryllithium Compounds. A Theoretical Study‏ ‎‡9 1‏
919 ‎‡a originofthesynchronicityinbondformationinpolardielsalderreactionsan11analysisofthereactionbetweencyclopentadieneandtetracyanoethylene‏ ‎‡A Origin of the synchronicity in bond formation in polar Diels–Alder reactions: an ELF analysis of the reaction between cyclopentadiene and tetracyanoethylene‏ ‎‡9 1‏
919 ‎‡a oxygenationofthephenylhalocarbenesaretheyspinallowedorspinforbiddenreactions‏ ‎‡A Oxygenation of the phenylhalocarbenes. Are they spin-allowed or spin-forbidden reactions?‏ ‎‡9 1‏
919 ‎‡a philicityindiceswithinthespinpolarizeddensityfunctionaltheoryframework‏ ‎‡A Philicity indices within the spin-polarized density-functional theory framework‏ ‎‡9 1‏
919 ‎‡a quantitativecharacterizationoftheglobalelectrophilicitypatternofsomereagentsinvolvedin13dipolarcycloadditionreactions‏ ‎‡A Quantitative characterization of the global electrophilicity pattern of some reagents involved in 1,3-dipolar cycloaddition reactions‏ ‎‡9 1‏
919 ‎‡a quantitativecharacterizationoftheglobalelectrophilicitypowerofcommondienedienophilepairsindielsalderreactions‏ ‎‡A Quantitative characterization of the global electrophilicity power of common diene/dienophile pairs in Diels–Alder reactions‏ ‎‡9 1‏
919 ‎‡a quantitativecharacterizationofthelocalelectrophilicityoforganicmoleculesunderstandingtheregioselectivityondielsalderreactions‏ ‎‡A Quantitative Characterization of the Local Electrophilicity of Organic Molecules. Understanding the Regioselectivity on Diels−Alder Reactions‏ ‎‡9 1‏
919 ‎‡a reactivityofthecarboncarbondoublebondtowardsnucleophilicadditionsadftanalysis‏ ‎‡A Reactivity of the carbon–carbon double bond towards nucleophilic additions. A DFT analysis‏ ‎‡9 1‏
919 ‎‡a relationshipbetweenbasicityandnucleophilicity‏ ‎‡A Relationship between basicity and nucleophilicity‏ ‎‡9 1‏
919 ‎‡a relationshipbetweensuperelectrophilicityandtheelectrophilicityindexofisolatedspecies‏ ‎‡A Relationship between Superelectrophilicity and the Electrophilicity Index of Isolated Species‏ ‎‡9 1‏
919 ‎‡a solventeffectsonelectrophilicity‏ ‎‡A Solvent Effects on Electrophilicity‏ ‎‡9 1‏
919 ‎‡a solventeffectsonglobalreactivitypropertiesforneutralandchargedsystemsusingthesequentialmontecarloquantummechanicsmodel‏ ‎‡A Solvent Effects on Global Reactivity Properties for Neutral and Charged Systems Using the Sequential Monte Carlo Quantum Mechanics Model‏ ‎‡9 1‏
919 ‎‡a spinphilicityandspindonicityasauxiliaryconceptstoquantifyspincatalysisphenomena‏ ‎‡A Spin-Philicity and Spin-Donicity as Auxiliary Concepts To Quantify Spin-Catalysis Phenomena‏ ‎‡9 1‏
919 ‎‡a mechanismofdoubleprotontransferindimersofuraciland2thiouracilthereactionforceperspective‏ ‎‡A The mechanism of double proton transfer in dimers of uracil and 2-thiouracil--the reaction force perspective.‏ ‎‡9 1‏
919 ‎‡a nucleophilicitynindexinorganicchemistry‏ ‎‡A The nucleophilicity N index in organic chemistry‏ ‎‡9 1‏
919 ‎‡a reactionforceconstantasanindicatorofsynchronicitynonsynchronicityincycloadditionprocesses‏ ‎‡A The reaction force constant as an indicator of synchronicity/nonsynchronicity in [4+2] cycloaddition processes‏ ‎‡9 1‏
919 ‎‡a theoreticalanalysisofsomesubstitutedimineenaminetautomerism‏ ‎‡A Theoretical analysis of some substituted imine-enamine tautomerism‏ ‎‡9 1‏
919 ‎‡a theoreticalanalysisofsubstituteddielsalderreagentstodeterminethepolarornonpolarcharacterofthereaction‏ ‎‡A Theoretical Analysis of Substituted Diels - Alder Reagents to Determine the Polar or Non Polar Character of the Reaction‏ ‎‡9 1‏
919 ‎‡a theoreticalevaluationoftheglobalandlocalelectrophilicitypatternsofsingletcarbenes‏ ‎‡A Theoretical Evaluation of the Global and Local Electrophilicity Patterns of Singlet Carbenes‏ ‎‡9 1‏
919 ‎‡a theoreticalinvestigationoftheselectivityinintramolecularcyclizationsofsome2aminochalconestodihydroquinolin8onesandindolin3ones‏ ‎‡A Theoretical investigation of the selectivity in intramolecular cyclizations of some 2’–aminochalcones to dihydroquinolin–8–ones and indolin–3–ones‏ ‎‡9 1‏
919 ‎‡a understanding100100bondformationinpolarreactionsan11analysisofthefriedelcraftsreactionbetweenindolesandnitroolefins‏ ‎‡A Understanding C–C bond formation in polar reactions. An ELF analysis of the Friedel–Crafts reaction between indoles and nitroolefins‏ ‎‡9 1‏
919 ‎‡a understandingthereactionmechanismbetweenacarbenoidintermediateandco2‏ ‎‡A Understanding the [2n+2n] reaction mechanism between a carbenoid intermediate and CO2‏ ‎‡9 1‏
919 ‎‡a understandingthebondformationinheterodielsalderreactionsan11analysisofthereactionofnitroethylenewithdimethylvinylamine‏ ‎‡A Understanding the Bond Formation in Hetero-Diels-Alder Reactions. An ELF Analysis of the Reaction of Nitroethylene with Dimethylvinylamine‏ ‎‡9 1‏
919 ‎‡a understandingthecarbenoidtypereactivityofnitrileylidesincycloadditionreactionstowardselectrondeficientethylenesamolecularelectrondensitytheorystudy‏ ‎‡A Understanding the carbenoid-type reactivity of nitrile ylides in [3+2] cycloaddition reactions towards electron-deficient ethylenes: a molecular electron density theory study‏ ‎‡9 1‏
919 ‎‡a understandingthechemicalreactivityofphenylhalocarbenesystemsananalysisbasedonthespinpolarizeddensityfunctionaltheory‏ ‎‡A Understanding the chemical reactivity of phenylhalocarbene systems: an analysis based on the spin-polarized density functional theory‏ ‎‡9 1‏
919 ‎‡a understandingthelocalreactivityinpolarorganicreactionsthroughelectrophilicandnucleophilicparrfunctions‏ ‎‡A Understanding the local reactivity in polar organic reactions through electrophilic and nucleophilic Parr functions‏ ‎‡9 1‏
919 ‎‡a understandingthemechanismofnonpolardielsalderreactionsacomparative11analysisofconcertedandstepwisediradicalmechanisms‏ ‎‡A Understanding the mechanism of non-polar Diels–Alder reactions. A comparative ELF analysis of concerted and stepwise diradical mechanisms‏ ‎‡9 1‏
919 ‎‡a understandingthepolarmechanismoftheenereactionadftstudy‏ ‎‡A Understanding the polar mechanism of the ene reaction. A DFT study‏ ‎‡9 1‏
919 ‎‡a understandingthereactivityofcaptodativeethylenesinpolarcycloadditionreactionsatheoreticalstudy‏ ‎‡A Understanding the Reactivity of Captodative Ethylenes in Polar Cycloaddition Reactions. A Theoretical Study†‏ ‎‡9 1‏
919 ‎‡a understandingtheregioselectivityinheterodielsalderreactionsan11analysisofthereactionbetweennitrosoethyleneand1vinylpyrrolidine‏ ‎‡A Understanding the regioselectivity in hetero Diels–Alder reactions. An ELF analysis of the reaction between nitrosoethylene and 1-vinylpyrrolidine‏ ‎‡9 1‏
919 ‎‡a understandingthethermaldehydrochlorinationreactionof1chlorohexanerevealingthedrivingbondingpatternattheplanarcatalyticreactioncenter‏ ‎‡A Understanding the thermal dehydrochlorination reaction of 1-chlorohexane. Revealing the driving bonding pattern at the planar catalytic reaction center‏ ‎‡9 1‏
919 ‎‡a unveilingthehighreactivityofcyclohexynesincycloadditionreactionsthroughthemolecularelectrondensitytheory‏ ‎‡A Unveiling the high reactivity of cyclohexynes in [3 + 2] cycloaddition reactions through the molecular electron density theory‏ ‎‡9 1‏
919 ‎‡a whydo5memberedheterocycliccompoundssometimesnotparticipateinpolardielsalderreactions‏ ‎‡A Why Do Five-Membered Heterocyclic Compounds Sometimes Not Participate in Polar Diels–Alder Reactions?‏ ‎‡9 1‏
919 ‎‡a πstraininducedelectrophilicityinsmallcycloalkynesadftanalysisofthepolarcycloadditionofcyclopentynetowardsenolethers‏ ‎‡A π-Strain-Induced Electrophilicity in Small Cycloalkynes: A DFT Analysis of the Polar Cycloaddition of Cyclopentyne towards Enol Ethers‏ ‎‡9 1‏
919 ‎‡a onthenatureofparrfunctionstopredictthemostreactivesitesalongorganicpolarreactions‏ ‎‡A On the nature of Parr functions to predict the most reactive sites along organic polar reactions‏ ‎‡9 1‏
919 ‎‡a combinedexperimentalandtheoreticalstudyofthepolarcycloadditionofelectrophilicallyactivatedcarbonylylideswithaldehydesandimines‏ ‎‡A A combined experimental and theoretical study of the polar [3 + 2] cycloaddition of electrophilically activated carbonyl ylides with aldehydes and imines‏ ‎‡9 1‏
919 ‎‡a comparativeanalysisoftheelectrophilicityoforganicmoleculesbetweenthecomputedipsandeasandthehomoandlumoenergies‏ ‎‡A A comparative analysis of the electrophilicity of organic molecules between the computed IPs and EAs and the HOMO and LUMO energies‏ ‎‡9 1‏
919 ‎‡a comparisonbetweentheoreticalandexperimentalmodelsofelectrophilicityandnucleophilicity‏ ‎‡A A comparison between theoretical and experimental models of electrophilicity and nucleophilicity‏ ‎‡9 1‏
919 ‎‡a computationalandconceptualdftstudyonthemechanismofhydrogenactivationbynovelfrustratedlewispairs‏ ‎‡A A computational and conceptual DFT study on the mechanism of hydrogen activation by novel frustrated Lewis pairs‏ ‎‡9 1‏
919 ‎‡a condensedtoatomnucleophilicityindexanapplicationtothedirectoreffectsontheelectrophilicaromaticsubstitutions‏ ‎‡A A condensed-to-atom nucleophilicity index. An application to the director effects on the electrophilic aromatic substitutions‏ ‎‡9 1‏
919 ‎‡a densityfunctionaltheoryformulationofthereactionfieldmodelofsolventeffects‏ ‎‡A A density functional theory formulation of the reaction field model of solvent effects‏ ‎‡9 1‏
919 ‎‡a dftanalysisoftheparticipationofzwitterionictacsinpolarcycloadditionreactions‏ ‎‡A A DFT analysis of the participation of zwitterionic TACs in polar [3+2] cycloaddition reactions‏ ‎‡9 1‏
919 ‎‡a dftstudyofinterandintramoleculararyneenereactions‏ ‎‡A A DFT Study of Inter- and Intramolecular Aryne Ene Reactions‏ ‎‡9 1‏
919 ‎‡a dftstudyoftheioniccycloadditionreactionsofketeniminiumcationswithterminalacetylenes‏ ‎‡A A DFT study of the ionic [2+2] cycloaddition reactions of keteniminium cations with terminal acetylenes‏ ‎‡9 1‏
919 ‎‡a furtherexplorationofanucleophilicityindexbasedonthegasphaseionizationpotentials‏ ‎‡A A further exploration of a nucleophilicity index based on the gas-phase ionization potentials‏ ‎‡9 1‏
919 ‎‡a mechanisticstudyoftheparticipationofazomethineylidesandcarbonylylidesincycloadditionreactions‏ ‎‡A A mechanistic study of the participation of azomethine ylides and carbonyl ylides in [3+2] cycloaddition reactions‏ ‎‡9 1‏
919 ‎‡a molecularelectrondensitytheorystudyofthecycloadditionreactionofnitroneswithstrainedallenes‏ ‎‡A A molecular electron density theory study of the [3 + 2] cycloaddition reaction of nitrones with strained allenes‏ ‎‡9 1‏
919 ‎‡a molecularelectrondensitytheorystudyoftheinsertionofcointofrustratedlewispairboronamidinesacycloadditionreaction‏ ‎‡A A molecular electron density theory study of the insertion of CO into frustrated Lewis pair boron-amidines: a [4 + 1] cycloaddition reaction‏ ‎‡9 1‏
919 ‎‡a newmodelfor100100bondformationprocessesderivedfromthemolecularelectrondensitytheoryinthestudyofthemechanismofcycloadditionreactionsofcarbenoidnitrileylideswithelectrondeficientethylenes‏ ‎‡A A new model for C–C bond formation processes derived from the Molecular Electron Density Theory in the study of the mechanism of [3+2] cycloaddition reactions of carbenoid nitrile ylides with electron-deficient ethylenes‏ ‎‡9 1‏
919 ‎‡a quantumchemicaltopologicalanalysisofthe100100bondformationinorganicreactionsinvolvingcationicspecies‏ ‎‡A A quantum chemical topological analysis of the C-C bond formation in organic reactions involving cationic species‏ ‎‡9 1‏
919 ‎‡a analysisoftheregioselectivityof13dipolarcycloadditionreactionsofbenzonitrilenoxidesbasedonglobalandlocalelectrophilicityandnucleophilicityindices‏ ‎‡A An Analysis of the Regioselectivity of 1,3-Dipolar Cycloaddition Reactions of BenzonitrileN-Oxides Based on Global and Local Electrophilicity and Nucleophilicity Indices‏ ‎‡9 1‏
919 ‎‡a medtstudyofthecarbenoidtypecycloadditionreactionsofnitrileylideswithelectrondeficientchiraloxazolidinones‏ ‎‡A An MEDT study of the carbenoid-type [3 + 2] cycloaddition reactions of nitrile ylides with electron-deficient chiral oxazolidinones‏ ‎‡9 1‏
919 ‎‡a understandingoftheelectrophilicnucleophilicbehaviorofelectrodeficient23disubstituted13butadienesinpolardielsalderreactionsadensityfunctionaltheorystudy‏ ‎‡A An understanding of the electrophilic/nucleophilic behavior of electro-deficient 2,3-disubstituted 1,3-butadienes in polar diels-alder reactions. A density functional theory study‏ ‎‡9 1‏
919 ‎‡a applicationsoftheconceptualdensityfunctionaltheoryindicestoorganicchemistryreactivity‏ ‎‡A Applications of the Conceptual Density Functional Theory Indices to Organic Chemistry Reactivity‏ ‎‡9 1‏
919 ‎‡a are1steparomaticnucleophilicsubstitutionsofnonactivatedbenzenesconcertedprocesses‏ ‎‡A Are one-step aromatic nucleophilic substitutions of non-activated benzenes concerted processes?‏ ‎‡9 1‏
919 ‎‡a chapter9theelectrophilicityindexinorganicchemistry‏ ‎‡A Chapter 9 The electrophilicity index in organic chemistry‏ ‎‡9 1‏
919 ‎‡a comparisonbetweenexperimentalandtheoreticalscalesofelectrophilicitybasedonreactivityindexes‏ ‎‡A Comparison between Experimental and Theoretical Scales of Electrophilicity Based on Reactivity Indexes‏ ‎‡9 1‏
919 ‎‡a comparisonbetweenexperimentalandtheoreticalscalesofelectrophilicityinbenzhydrylcations‏ ‎‡A Comparison between experimental and theoretical scales of electrophilicity in benzhydryl cations‏ ‎‡9 1‏
919 ‎‡a complementarityofreactionforceandelectronlocalizationfunctionanalysesofasynchronicityinbondformationindielsalderreactions‏ ‎‡A Complementarity of reaction force and electron localization function analyses of asynchronicity in bond formation in Diels–Alder reactions‏ ‎‡9 1‏
919 ‎‡a definitionofanucleophilicityscale‏ ‎‡A Definition of a Nucleophilicity Scale‏ ‎‡9 1‏
919 ‎‡a densityfunctionaltheorystudyforthecycloadditionof13butadieneswithdimethylacetylenedicarboxylatepolarstepwisevsconcertedmechanisms‏ ‎‡A Density Functional Theory Study for the Cycloaddition of 1,3-Butadienes with Dimethyl Acetylenedicarboxylate. Polar Stepwise vs Concerted Mechanisms‏ ‎‡9 1‏
919 ‎‡a dosubstituentsmakeanycontributiontotheformationofsystemswheretheelectroniceffectsseemtobeneutralizedthecaseoftheindigodyeformation‏ ‎‡A Do substituents make any contribution to the formation of systems where the electronic effects seem to be neutralized? The case of the indigo dye formation‏ ‎‡9 1‏
919 ‎‡a dualdescriptorswithintheframeworkofspinpolarizeddensityfunctionaltheory‏ ‎‡A Dual descriptors within the framework of spin-polarized density functional theory‏ ‎‡9 1‏
919 ‎‡a effectoftheexchangecorrelationfunctionalonthesynchronicitynonsynchronicityinbondformationindielsalderreactionsareactionforceconstantanalysis‏ ‎‡A Effect of the exchange-correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels-Alder reactions: a reaction force constant analysis‏ ‎‡9 1‏
919 ‎‡a electroniccontributionstothesigma‏ ‎‡A Electronic contributions to the sigma‏ ‎‡9 1‏
919 ‎‡a electroniccontributionstothesigmapparameterofthehammettequation‏ ‎‡A Electronic contributions to the sigma(p) parameter of the Hammett equation.‏ ‎‡9 1‏
919 ‎‡a empiricalenergydensityrelationshipsappliedtotheanalysisofthebasicityofstrongorganicsuperbases‏ ‎‡A Empirical Energy−Density Relationships Applied to the Analysis of the Basicity of Strong Organic Superbases‏ ‎‡9 1‏
919 ‎‡a exploring2statereactivitypathwaysinthecycloadditionreactionsoftripletmethylene‏ ‎‡A Exploring Two-State Reactivity Pathways in the Cycloaddition Reactions of Triplet Methylene‏ ‎‡9 1‏
919 ‎‡a furtherrelationshipsbetweentheoreticalandexperimentalmodelsofelectrophilicityandnucleophilicity‏ ‎‡A Further relationships between theoretical and experimental models of electrophilicity and nucleophilicity‏ ‎‡9 1‏
919 ‎‡a globalandlocalelectrophilicitypatternsofdiazoniumionsandtheirreactivitytowardπnucleophiles‏ ‎‡A Global and Local Electrophilicity Patterns of Diazonium Ions and Their Reactivity toward π-Nucleophiles‏ ‎‡9 1‏
919 ‎‡a globalandlocalreactivityindicesforelectrophilicnucleophilicfreeradicals‏ ‎‡A Global and local reactivity indices for electrophilic/nucleophilic free radicals‏ ‎‡9 1‏
919 ‎‡a globalandlocalreactivityofnheterocycliccarbeneswithboronandphosphorusatomsananalysisbasedonspinpolarizeddensityfunctionalframework‏ ‎‡A Global and local reactivity of N-heterocyclic carbenes with boron and phosphorus atoms: An analysis based on spin polarized density functional framework‏ ‎‡9 1‏
919 ‎‡a globalandlocalreactivityofsimplesubstitutednitrenesandphosphinideneswithinthespinpolarizeddensityfunctionaltheoryframework‏ ‎‡A Global and local reactivity of simple substituted nitrenes and phosphinidenes within the spin-polarized density functional theory framework‏ ‎‡9 1‏
919 ‎‡a intrinsicelectronicreorganizationenergyintheelectrontransferfromsubstitutednndimethylanilinestophthalimidenoxylradical‏ ‎‡A Intrinsic electronic reorganization energy in the electron transfer from substituted N,N-dimethylanilines to phthalimide N-oxyl radical‏ ‎‡9 1‏
919 ‎‡a intrinsicrelativenucleophilicityofindoles‏ ‎‡A Intrinsic relative nucleophilicity of indoles‏ ‎‡9 1‏
919 ‎‡a intrinsicrelativescalesofelectrophilicityandnucleophilicity‏ ‎‡A Intrinsic Relative Scales of Electrophilicity and Nucleophilicity‏ ‎‡9 1‏
919 ‎‡a isoelectronicandisolobaloch2ch3+andbh3aselectronpairssimilaritiesbetweenmolecularandsolidstatechemistry‏ ‎‡A Isoelectronic and isolobal O, CH2, CH3+ and BH3 as electron pairs; similarities between molecular and solid-state chemistry‏ ‎‡9 2‏
946 ‎‡a a‏ ‎‡9 1‏
996 ‎‡2 LC|n 93100148‏
996 ‎‡2 CAOONL|ncf10176997‏
996 ‎‡2 SUDOC|150245653‏
996 ‎‡2 SUDOC|255476191‏
996 ‎‡2 ISNI|0000000035580034‏
996 ‎‡2 LC|no2011122171‏
996 ‎‡2 SUDOC|233481702‏
996 ‎‡2 SUDOC|273056263‏
996 ‎‡2 LC|no2019189427‏
996 ‎‡2 BNE|XX1758851‏
996 ‎‡2 BNC|981058526936206706‏
996 ‎‡2 BNC|981060409488906706‏
996 ‎‡2 BNE|XX1702442‏
996 ‎‡2 ISNI|0000000060082491‏
996 ‎‡2 RERO|A012104003‏
996 ‎‡2 LC|no2015115582‏
996 ‎‡2 LC|n 2015017972‏
996 ‎‡2 ISNI|0000000432349848‏
996 ‎‡2 BNF|16607337‏
996 ‎‡2 LC|no 96045848‏
996 ‎‡2 BNCHL|10000000000000000263025‏
996 ‎‡2 ISNI|0000000031248982‏
996 ‎‡2 BNC|981058614316106706‏
996 ‎‡2 BNE|XX5343413‏
996 ‎‡2 DNB|1345857136‏
996 ‎‡2 LC|n 96042474‏
996 ‎‡2 LC|no2017146074‏
996 ‎‡2 BNE|XX5340670‏
996 ‎‡2 LC|n 2023050813‏
996 ‎‡2 PLWABN|9813135109505606‏
996 ‎‡2 DNB|135723337‏
996 ‎‡2 BNCHL|10000000000000000822297‏
996 ‎‡2 LC|n 97093754‏
996 ‎‡2 SUDOC|165009454‏
996 ‎‡2 BNE|XX4993991‏
996 ‎‡2 LC|no2008119368‏
996 ‎‡2 BNE|XX4617184‏
996 ‎‡2 BNE|XX1164703‏
996 ‎‡2 LIH|LNB:DSO_l_;=B_o_‏
996 ‎‡2 LC|no2019046760‏
996 ‎‡2 J9U|987012330127405171‏
996 ‎‡2 LC|no2016052412‏
996 ‎‡2 BNC|981060034134906706‏
996 ‎‡2 BNE|XX1537739‏
996 ‎‡2 NTA|338934839‏
996 ‎‡2 BNE|XX5764588‏
996 ‎‡2 BNE|XX914248‏
996 ‎‡2 CAOONL|ncf11576009‏
996 ‎‡2 BNC|981058509113706706‏
996 ‎‡2 BNE|XX5040972‏
996 ‎‡2 BNE|XX4869671‏
996 ‎‡2 BNE|XX5872755‏
996 ‎‡2 BNE|XX5653276‏
996 ‎‡2 LC|no2009133672‏
996 ‎‡2 BNE|XX5523168‏
996 ‎‡2 NLR|RU NLR AUTH 7760395‏
996 ‎‡2 LC|n 2006037868‏
996 ‎‡2 ISNI|0000000447362893‏
996 ‎‡2 NTA|069762473‏
996 ‎‡2 BNC|981058508204306706‏
996 ‎‡2 LC|n 2018013006‏
996 ‎‡2 DNB|1159600619‏
996 ‎‡2 ISNI|0000000060221412‏
996 ‎‡2 PLWABN|9810624454005606‏
996 ‎‡2 ISNI|0000000061100938‏
996 ‎‡2 BNCHL|10000000000000000827650‏
996 ‎‡2 PLWABN|9811538473405606‏
996 ‎‡2 RERO|A013843985‏
996 ‎‡2 LC|no2016132474‏
996 ‎‡2 LC|n 2018069220‏
996 ‎‡2 DNB|1159064741‏
996 ‎‡2 DNB|1060686686‏
996 ‎‡2 ISNI|0000000120955160‏
996 ‎‡2 BNC|981058521040106706‏
996 ‎‡2 LC|n 2021051149‏
996 ‎‡2 SUDOC|075981807‏
996 ‎‡2 SUDOC|275073033‏
996 ‎‡2 LC|no2010002847‏
996 ‎‡2 BNE|XX929529‏
996 ‎‡2 LC|n 00005245‏
996 ‎‡2 BLBNB|001128957‏
996 ‎‡2 SUDOC|092791352‏
996 ‎‡2 BNE|XX5578946‏
996 ‎‡2 ISNI|0000000118523924‏
996 ‎‡2 ISNI|0000000032060631‏
996 ‎‡2 BNC|981058609887706706‏
996 ‎‡2 ISNI|0000000060383964‏
996 ‎‡2 DNB|13260017X‏
996 ‎‡2 LC|no2023040094‏
996 ‎‡2 ISNI|000000008112876X‏
996 ‎‡2 CAOONL|ncf11465108‏
996 ‎‡2 NUKAT|n 2007278663‏
996 ‎‡2 SUDOC|270978852‏
996 ‎‡2 BNC|981058516035806706‏
996 ‎‡2 DNB|1205009485‏
996 ‎‡2 BNC|981058615480606706‏
996 ‎‡2 BNF|16982617‏
996 ‎‡2 BNE|XX923367‏
996 ‎‡2 DNB|1247666158‏
996 ‎‡2 ISNI|0000000360217124‏
996 ‎‡2 LC|n 2020034383‏
996 ‎‡2 LC|n 2003109960‏
996 ‎‡2 SUDOC|255586663‏
996 ‎‡2 BNE|XX6075831‏
996 ‎‡2 DNB|1056595809‏
996 ‎‡2 BNE|XX6168755‏
996 ‎‡2 DNB|123982596X‏
996 ‎‡2 LC|no2007033275‏
996 ‎‡2 DNB|1188746200‏
996 ‎‡2 PTBNP|1436964‏
996 ‎‡2 CAOONL|ncf10580188‏
996 ‎‡2 SUDOC|264915569‏
996 ‎‡2 SUDOC|094785678‏
996 ‎‡2 BNE|XX4583785‏
996 ‎‡2 LC|n 2014185075‏
996 ‎‡2 ISNI|0000000501776262‏
996 ‎‡2 ISNI|0000000075201799‏
996 ‎‡2 SUDOC|163606145‏
996 ‎‡2 SUDOC|087248875‏
996 ‎‡2 BNC|981058615927906706‏
996 ‎‡2 NSK|000461319‏
996 ‎‡2 BNCHL|10000000000000000231752‏
996 ‎‡2 BNCHL|10000000000000000009150‏
996 ‎‡2 BNE|XX1103594‏
997 ‎‡a 0 0 lived 0 0‏ ‎‡9 1‏