LEADER 05345nam 2200721 450 001 9910131369403321 005 20230808211707.0 010 $a1-5231-1055-4 010 $a1-119-04429-4 010 $a1-119-04430-8 010 $a1-119-04419-7 035 $a(CKB)3710000000437525 035 $a(EBL)2075007 035 $a(SSID)ssj0001515676 035 $a(PQKBManifestationID)12550798 035 $a(PQKBTitleCode)TC0001515676 035 $a(PQKBWorkID)11482722 035 $a(PQKB)11238827 035 $a(PQKBManifestationID)16203435 035 $a(PQKB)20901317 035 $a(MiAaPQ)EBC2075007 035 $a(DLC) 2015014391 035 $a(Au-PeEL)EBL2075007 035 $a(CaPaEBR)ebr11071168 035 $a(CaONFJC)MIL804023 035 $a(OCoLC)912237441 035 $a(EXLCZ)993710000000437525 100 $a20150710h20162016 uy 0 101 0 $aeng 135 $aur||||||||||| 181 $ctxt 182 $cc 183 $acr 200 10$aSolvent effects in chemistry /$fErwin Buncel, Robert A. Stairs 205 $aSecond edition. 210 1$aHoboken, New Jersey :$cWiley,$d2016. 210 4$d©2016 215 $a1 online resource (528 p.) 300 $aDescription based upon print version of record. 311 $a1-119-03098-6 320 $aIncludes bibliographical refererences and index. 327 $aCOVER; TABLE OF CONTENTS; TITLE PAGE; PREFACE TO THE SECOND EDITION; PREFACE TO THE FIRST EDITION; 1 PHYSICOCHEMICAL FOUNDATIONS; 1.1 GENERALITIES; 1.2 CLASSIFICATION OF SOLVENTS; 1.3 SOLVENTS IN THE WORKPLACE AND THE ENVIRONMENT; 1.4 SOME ESSENTIAL THERMODYNAMICS AND KINETICS: TENDENCY AND RATE; 1.5 EQUILIBRIUM CONSIDERATIONS; 1.6 THERMODYNAMIC TRANSFER FUNCTIONS; 1.7 KINETIC CONSIDERATIONS: COLLISION THEORY; 1.8 TRANSITION-STATE THEORY; 1.9 REACTIONS IN SOLUTION; 1.10 DIFFUSION-CONTROLLED REACTIONS; 1.11 REACTION IN SOLUTION AND THE TRANSITION-STATE THEORY; PROBLEMS; 2 UNREACTIVE SOLVENTS 327 $a2.1 INTERMOLECULAR POTENTIALS 2.2 ACTIVITY AND EQUILIBRIUM IN NONELECTROLYTE SOLUTIONS; 2.3 KINETIC SOLVENT EFFECTS; 2.4 SOLVENT POLARITY; 2.5 ELECTROSTATIC FORCES; 2.6 ELECTROLYTES IN SOLUTION; 2.7 SOLVATION; 2.8 SINGLE ION SOLVATION; 2.9 IONIC ASSOCIATION; 2.10 SOLVENT MIXTURES; 2.11 SALT EFFECTS; PROBLEMS; 3 REACTIVE SOLVENTS; 3.1 SPECIFIC SOLUTE/SOLVENT INTERACTIONS; 3.2 HYDROGEN BONDING; 3.3 ACIDS AND BASES IN SOLVENTS; 3.4 BRØNSTED-LOWRY ACIDS AND BASES; 3.5 ACIDITY FUNCTIONS; 3.6 ACIDS AND BASES IN KINETICS; 3.7 LEWIS ACIDS AND BASES; 3.8 HARD AND SOFT ACIDS AND BASES (HSAB) 327 $a3.9 SCALES OF HARDNESS OR SOFTNESS 3.10 ACIDS AND BASES IN REACTIVE APROTIC SOLVENTS; 3.11 EXTREMES OF ACIDITY AND BASICITY; 3.12 OXIDATION AND REDUCTION; 3.13 ACIDITY/REDOX DIAGRAMS; 3.14 UNIFICATION OF ACID-BASE AND REDOX CONCEPTS; PROBLEMS; 4 CHEMOMETRICS: SOLVENT EFFECTS AND STATISTICS; 4.1 LINEAR FREE ENERGY RELATIONSHIPS; 4.2 CORRELATIONS BETWEEN EMPIRICAL PARAMETERS AND OTHER MEASURABLE SOLVENT PROPERTIES; 4.3 REPRESENTATION OF CORRELATION DATA ON THE HEMISPHERE; 4.4 SOME PARTICULAR CASES; 4.5 ACIDITY AND BASICITY PARAMETERS; 4.6 BASE SOFTNESS PARAMETERS; 4.7 CONCLUSION 327 $a5 THEORIES OF SOLVENT EFFECTS 5.1 INTRODUCTION: MODELING; 5.2 QUANTUM-MECHANICAL METHODS; 5.3 STATISTICAL-MECHANICAL METHODS; 5.4 INTEGRAL EQUATION THEORIES; 5.5 SOLVATION CALCULATIONS; 5.6 SOME RESULTS; PROBLEMS; 6 DIPOLAR APROTIC SOLVENTS; 6.1 INTRODUCTION; 6.2 ACIDITIES IN DMSO AND THE H-SCALE IN DMSO-H2O MIXTURES; 6.3 USE OF THERMODYNAMIC TRANSFER FUNCTIONS; 6.4 CLASSIFICATION OF RATE PROFILE-MEDIUM EFFECT REACTION TYPES; 6.5 BIMOLECULAR NUCLEOPHILIC SUBSTITUTION; 6.6 PROTON TRANSFER; 6.7 D2-HO EXCHANGE; PROBLEMS; 7 EXAMPLES OF OTHER SOLVENT CLASSES; 7.1 INTRODUCTION; 7.2 ACIDIC SOLVENTS 327 $a7.3 BASIC SOLVENTS 7.4 CHIRAL SOLVENTS; 8 NEW SOLVENTS AND GREEN CHEMISTRY; 8.1 NEOTERIC SOLVENTS; 8.2 SUPERCRITICAL FLUIDS; 8.3 IONIC LIQUIDS; 8.4 LOW-TRANSITION-TEMPERATURE MIXTURES; 8.5 BIO-BASED SOLVENTS; 8.6 FLUOROUS SOLVENTS; 8.7 SWITCHABLE SOLVENTS; 8.8 GREEN SOLVENT CHEMISTRY; 9 CONCLUDING OBSERVATIONS; 9.1 CHOOSING A SOLVENT; 9.2 ENVOI; APPENDIX; ANSWERS; CHAPTER 1; CHAPTER 2; CHAPTER 3; CHAPTER 6; REFERENCES; INDEX; END USER LICENSE AGREEMENT 330 $aThis book introduces the concepts, theory and experimental knowledge concerning solvent effects on the rate and equilibrium of chemical reactions of all kinds. It begins with basic thermodynamics and kinetics, building on this foundation to demonstrate how a more detailed understanding of these effects may be used to aid in determination of reaction mechanisms, and to aid in planning syntheses. Consideration is given to theoretical calculations (quantum chemistry, molecular dynamics, etc.), to statistical methods (chemometrics), and to modern day concerns such as ""green"" chemistry, where ut 606 $aSolvation 606 $aChemical reactions 606 $aSolvents 615 0$aSolvation. 615 0$aChemical reactions. 615 0$aSolvents. 676 $a541/.34 700 $aBuncel$b E.$0956763 702 $aStairs$b R. A$g(Robert A.), 801 0$bMiAaPQ 801 1$bMiAaPQ 801 2$bMiAaPQ 906 $aBOOK 912 $a9910131369403321 996 $aSolvent effects in chemistry$92167004 997 $aUNINA