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Book Cover
E-book
Author Carroll, Felix A

Title Perspectives on Structure and Mechanism in Organic Chemistry
Published Newark : John Wiley & Sons, Incorporated, 2010

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Description 1 online resource (966 p.)
Series New York Academy of Sciences Ser
New York Academy of Sciences Ser
Contents Cover -- Title Page -- Copyright Page -- Contents -- Preface -- Acknowledgments -- Introduction -- Chapter 1 Fundamental Concepts of Organic Chemistry -- 1.1 Atoms and Molecules -- Fundamental Concepts -- Molecular Dimensions -- 1.2 Heats of Formation and Reaction -- Experimental Determination of Heats of Formation -- Bond Increment Calculation of Heats of Formation -- Group Increment Calculation of Heats of Formation -- Homolytic and Heterolytic Bond Dissociation Energies -- 1.3 Bonding Models -- Electronegativity and Bond Polarity -- Complementary Theoretical Models of Bonding
Symmetric, Asymmetric, Dissymmetric, and Nondissymmetric Molecules -- Designation of Molecular Configuration -- Fischer Projections -- Additional Stereochemical Nomenclature -- 2.3 Manifestations of Stereoisomerism -- Optical Activity -- Configuration and Optical Activity -- Other Physical Properties of Stereoisomers -- 2.4 Stereotopicity -- Stereochemical Relationships of Substituents -- Chirotopicity and Stereogenicity -- Problems -- Chapter 3 Conformational Analysis and Molecular Mechanics -- 3.1 Molecular Conformation -- 3.2 Conformational Analysis -- Torsional Strain -- van der Waals Strain
Angle Strain and Baeyer Strain Theory -- Application of Conformational Analysis to Cycloalkanes -- Conformational Analysis of Substituted Cyclohexanes -- 3.3 Molecular Mechanics -- 3.4 Molecular Strain and limits to Molecular Stability -- Problems -- Chapter 4 Applications of Molecular Orbital Theory and Valence Bond Theory -- 4.1 Introduction to Molecular Orbital Theory -- Huckel Molecular Orbital Theory -- Correlation of Physical Properties with Results of HMO Calculations -- Other Parameters Generated Through HMO Theory -- Properties of Odd Alternant Hydrocarbons -- The Circle Mnemonic
4.2 Aromaticity -- Benzene -- Aromaticity in Small Ring Systems -- Larger Annulenes -- Dewar Resonance Energy and Absolute Hardness -- 4.3 Contemporary Computational Methods -- Extended Hückel Theory -- Perturbational Molecular Orbital Theory -- Atoms in Molecules -- Density Functional Theory -- 4.4 Valence Bond Theory -- Resonance Structures and Resonance Energies -- Choosing a Computational Model -- Problems -- Chapter 5 Reactive Intermediates -- 5.1 Reaction Coordinate Diagrams -- 5.2 Radicals -- Early Evidence for the Existence of Radicals -- Detection and Characterization of Radicals
Notes Description based upon print version of record
Structure and Bonding of Radicals
Form Electronic book
ISBN 9781118018170
1118018176