Structural Descriptors of Benzenoid Hydrocarbons: A Mismatch between the Estimates and Parity Effects in Helicenes

Structural Descriptors of Benzenoid Hydrocarbons: A Mismatch between the Estimates and Parity Effects in Helicenes

Benzenoid hydrocarbons have regular structures, attracting the opportunity to test the structural descriptors of their series. In the present study, we compared information entropy, Wiener indices, topological efficiencies, topological roundness, and symmetries of oligoacenes, phenacenes, and helice...

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Bibliographic Details
Main Authors: Denis Sh. Sabirov, Ottorino Ori, Alina A. Tukhbatullina, Igor S. Shepelevich
Format: Article
Language:English
Published: MDPI AG 2022-08-01
Series:C
Subjects:
PAH
oligoacenes
phenacenes
helicenes
information entropy
topological roundness
Online Access:https://www.mdpi.com/2311-5629/8/3/42

Internet

https://www.mdpi.com/2311-5629/8/3/42

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