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Bachrach, Steven M.
Computational Organic Chemistry

1. Edition - August 2007
119.- Euro
2007. 496 Pages, Hardcover
- Practical Approach Book -
ISBN-10: 0-471-71342-2
ISBN-13: 978-0-471-71342-5 - John Wiley & Sons


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Sample Chapter

Short description
Computational Organic Chemistry introduces the computational modeling methods used as standard tools by organic chemists for searching for, rationalizing, and predicting structure and reactivity of organic molecules. Topics discussed include: simple molecular properties, pericyclic reactions, carbenes and radicals, anion chemistry, solvent effects, and more.

From the contents
Acknowledgements.

Preface.

Chapter 1. Quantum Mechanics for Organic Chemistry .

Chapter 2. Fundamentals of Organic Chemistry.

Chapter 3. Pericyclic Reactions.

Chapter 4. Diradicals and Carbenes.

Chapter 5.Organic Reactions of Anions.

Chapter 6. Solution-Phase Organic Chemistry.

Chapter 7. Organic Reaction Dynamics.


 
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