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Gleiter, Rolf / Haberhauer, G.
Aromaticity and Other Conjugation Effects

1. Auflage August 2012
59,- Euro
2012. XIV, 452 Seiten, Softcover
- Lehrbuch -
ISBN 978-3-527-32934-2 - Wiley-VCH, Weinheim

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Langtext
Die anregende Lektüre vermittelt Ihnen die wichtigsten Ansätze zur Beschreibung von Molekülen mit konjugierten Bindungen und ihren spezifischen Eigenschaften. Die vorgestellten Zusammenhänge zwischen Struktur, Spektren und Reaktivität lassen sich für viele organische Moleküle verallgemeinern.

Aus dem Inhalt
CONJUGATED pi-SYSTEMS
Linear Conjugated Polyenes
Conjugated Oligoalkynes
Conjugated Planar Monocyclic Systems
Aromaticity Criteria
Structures of Monocyclic (4n)pi and (4n+2)pi Annulenes
Conjugated Polycyclic Planar pi Electron Systems
Substituent Effects
Conjugation in Two and Three Dimensions

THROUGH-SPACE INTERACTION BETWEEN pi SYSTEMS
Homoconjugation
Transannular Effects
Homoaromatic Systems
Spiroconjugation

DONOR-ACCEPTOR INTERACTIONS BETWEEN PLANAR ARENES
Donor-Acceptor Complexes
Structures of Benzene and Related Aromatics in the Solid State
Interactions Between Molecules of Opposite Electric Quadrupole Moments
Model Studies to Measure the Strength of Non-Covalent Interactions Between pi Systems in Organic Solvents
Model Calculations on pi-pi Interactions
Applications and Consequences of pi-pi Interactions of Arenes in Chemistry

THROUGH-BOND INTERACTION BETWEEN pi SYSTEMS AND NON-BONDING ELECTRON PAIRS OF HETEROATOMS
Theoretical Models
Dehydroaromatics
Through-Bond Interaction Between Non-Conjugated pi Systems
Rationalization of Intramolecular Reactivity by Through-Bond Coupling

HYPERCONJUGATIVE INTERACTIONS
Concept of the Two-Electron/Two-Orbital Interactions
Definition and Manifestation on Ground State Properties
Positive Hyperconjugation (sigma-p, sigma-pi* and sigma-sigma* Interactions)
Negative Hyperconjugation (n-sigma* and pi-sigma* Interactions)

THEORETICAL METHODS
Quantum Chemical Calculation Methods - An Overview
Orbital Interactions
Spectroscopic Methods for Detecting Conjugation Effects

APPENDIX
Character Tables for Selected Symmetry Groups
Basic Equations for Nuclear Magnetic Shielding in Molecules
Energy Conversion Table and Abbreviations


 





 

        

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