Volume 107, 2011
From the journal:

Annual Reports Section "B" (Organic Chemistry)

Computational organic chemistry

Steven M. Bachracha  

a Department of Chemistry, Trinity University, One Trinity Place, San Antonio, USA
E-mail: sbachrach@trinity.edu
Fax: +1 210-999-7569
Tel: +1 210-999-7379

Abstract

The 2010 literature pertaining to computational organic chemistry is summarized and reviewed. Highlights include the novel structure of the propellane radical cation, the putative claim for the preparation and characterization of 1,3-dimethylcyclobutadiene, new annulenes with Möbius topology, tunneling within phenylhydroxycarbene, a new method for using computed NMR spectra to identify structure, and a new model to rationalize the protobranching effect.

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Article information

DOI
https://doi.org/10.1039/C1OC90002A
Article type
Review Article
First published
19 May 2011

Annu. Rep. Prog. Chem., Sect. B: Org. Chem., 2011,107, 349-368

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Computational organic chemistry

S. M. Bachrach, Annu. Rep. Prog. Chem., Sect. B: Org. Chem., 2011, 107, 349 DOI: 10.1039/C1OC90002A

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