Manifestations of antiaromaticity in organic materials: Case studies of cyclobutadiene, borole, and pentalene

C Hong, J Baltazar, JD Tovar - European Journal of Organic …, 2022 - Wiley Online Library
This Review surveys the experimental and synthetic history of three classic antiaromatic
cores: cyclobutadiene, borole, and pentalene. The coverage extends from the bare …

Antiaromatic covalent organic frameworks based on dibenzopentalenes

J Sprachmann, T Wachsmuth, M Bhosale… - Journal of the …, 2023 - ACS Publications
Despite their inherent instability, 4 n π systems have recently received significant attention
due to their unique optical and electronic properties. In dibenzopentalene (DBP) …

Aromaticity controls the excited-state properties of host–guest complexes of nanohoops

G George, OA Stasyuk, AA Voityuk, AJ Stasyuk, M Solà - Nanoscale, 2023 - pubs.rsc.org
π-Conjugated organic molecules have exciting applications as materials for batteries, solar
cells, light-emitting diodes, etc. Among these systems, antiaromatic compounds are of …

Synthesis and Characterization of Dibenzothieno[a,f]pentalenes Enabling Large Antiaromaticity and Moderate Open-Shell Character through a Small Energy Barrier …

Y Mizuno, A Nogata, M Suzuki… - Journal of the …, 2023 - ACS Publications
Experimental and theoretical rationalization of bond-shift valence tautomerization,
characterized by double-well potential surfaces, is one of the most challenging topics of …

Bisazapentalene dication: global aromaticity and open-shell singlet ground state

Y Han, J Zhu, S Dong, Y Eng, T Tao… - Organic …, 2023 - ACS Publications
Antiaromatic moieties fused in polycyclic π-conjugated molecules usually exhibit strong
localized antiaromaticiy. Herein, we reported the synthesis and properties of a …

Antiaromatic Molecules as Magnetic Couplers: A Computational Quest

S Shil, D Bhattacharya, A Misra… - The Journal of Physical …, 2024 - ACS Publications
In this study, we investigate a set of organic diradical structures in which two oxo-verdazyl
radicals are selected as radical spin centers that are connected (coupled) via six coupler …

Rational design of organic diradicals with robust high-spin ground state based on antiaromatic linkers

R Santiago, MÀ Carvajal, J Poater, I de PR Moreira… - Chemical …, 2025 - pubs.rsc.org
Fully-organic molecules with high-spin ground states are promising building blocks for new
lightweight flexible magnetic materials for emerging technological applications (eg …

Excited State Processes in Supramolecular Complexes of Cyclic Dibenzopyrrolopyrrole Isomers with C60 Fullerene

G George, OA Stasyuk, AA Voityuk… - … A European Journal, 2023 - Wiley Online Library
An approach to modulating the properties of carbon nanorings by incorporating pyrrolo [3, 2‐
b] pyrrole units is of particular interest due to the combined effect of heteroatom and …

Modulating Paratropicity in Heteroarene-Fused Expanded Pentalenes

S Jalife, A Tsybizova, R Gershoni-Poranne… - Organic Letters, 2024 - ACS Publications
Pentalenes are formally eight-π-electron antiaromatic, but π-expanded pentalenes can
display varying levels of paratropicity depending on the choice of annelated (hetero) arenes …

Reversible Single Electron Redox Steps Convert Polycycles with a C3P3 Core to a Planar Triphosphinine

P Coburger, C Schweinzer, Z Li… - Angewandte Chemie …, 2023 - Wiley Online Library
Reaction of the imidazolium‐stabilized diphosphete‐diide IDP with trityl phosphaalkyne
affords a mixture which contains the molecules 1 a and 1 b with a central C3P3 core, which …