Theoretical Investigation on C11H8 Bicyclic Carbene and Allene Isomers

Theoretical Investigation on C11H8 Bicyclic Carbene and Allene Isomers

Recent studies postulate that the presence of polycyclic aromatic hydrocarbons (PAHs) in the interstellar medium (ISM) could have been formed through resonance-stabilized arylcarbene intermediates. However, identifying most of these reactive intermediates is very challenging experimentally due to th...

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Bibliographic Details
Main Authors: Tarun Roy, Sayon Satpati, Venkatesan S. Thimmakondu, Subhas Ghosal
Format: Article
Language:English
Published: Frontiers Media S.A. 2022-06-01
Series:Frontiers in Physics
Subjects:
C11H8
carbene
PAHs
PyAR
DFT
Online Access:https://www.frontiersin.org/articles/10.3389/fphy.2022.907466/full

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