Hexacyclo[7.1.0.0^1,3.0^3,5.0^5,7.0^7,9]decane, or Pentagramane: High-Level Computational Studies on a Novel Hydrocarbon

Authors

David W. Ball, Cleveland State UniversityFollow

Document Type

Article

Publication Date

2008

Publication Title

Journal of Physical Organic Chemistry

Abstract

A novel hydrocarbon whose line diagram is that of the classic pentagram is described. High-level computational studies have been performed to determine its structure, vibrational frequencies, NMR spectra, and thermochemistry.

Recommended Citation

Ball, D. W. Hexacyclo[7.1.0.0^1,3.0^3,5.0^5,7.0^7,9]decane, or pentagramane: high-level computational studies on a novel hydrocarbon. Journal of Physical Organic Chemistry 2008, 21, 387-392.

DOI

10.1002/poc.1360

Volume

21

Issue

5