Intramolecular multi-bond strain: the unrecognized side of the dichotomy of conjugated systems

Author:

Mo Yirong12345,Zhang Huaiyu12345,Su Peifeng12345,Jarowski Peter D.6789,Wu Wei12345

Affiliation:

1. The State Key Laboratory of Physical Chemistry of Solid Surfaces

2. Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry and College of Chemistry and Chemical Engineering

3. Xiamen University

4. Xiamen

5. China

6. University of Surrey

7. Advanced Technology Institute

8. Guildford

9. UK

Abstract

Apart from the more familiar π-conjugation, there is also significant π–π repulsion which is a kind of unrecognized intramolecular strain and can be quantified with the linear B4H2 model system.

Funder

Directorate for Computer and Information Science and Engineering

Western Michigan University

China Scholarship Council

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemistry

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