Open-shell graphene fragments

W Zeng, J Wu - Chem, 2021 - cell.com
The electronic properties of finite-sized graphene fragments are strongly dependent on their
topological structures. The existence of two or more extended zigzag edges could lead to …

Molecular semiconductors for logic operations: dead‐end or bright future?

G Schweicher, G Garbay, R Jouclas, F Vibert… - Advanced …, 2020 - Wiley Online Library
The field of organic electronics has been prolific in the last couple of years, leading to the
design and synthesis of several molecular semiconductors presenting a mobility in excess of …

Antiaromatic Dicyclopenta[b,g]/[a,f]naphthalene Isomers Showing an Open-Shell Singlet Ground State with Tunable Diradical Character

T Xu, Y Han, Z Shen, X Hou, Q Jiang… - Journal of the …, 2021 - ACS Publications
Since the first isolation of 1, 3, 5, 7-tetra-tert-butyl-s-indacene in 1986, core-expanded s-and
as-indacenes have attracted intensive interest. However, there is no reported synthesis of …

Efficient singlet fission and triplet-pair emission in a family of zethrene diradicaloids

S Lukman, JM Richter, L Yang, P Hu, J Wu… - Journal of the …, 2017 - ACS Publications
Singlet fission offers the potential to overcome thermodynamic limits in solar cells by
converting the energy of a single absorbed photon into two distinct triplet excitons. However …

Dearomatization of 3‐nitroindoles by a phosphine‐catalyzed enantioselective [3+ 2] annulation reaction

K Li, TP Gonçalves, KW Huang… - Angewandte Chemie …, 2019 - Wiley Online Library
The dearomatization of 3‐nitroindoles through a chiral‐phosphine‐mediated [3+ 2]
annulation reaction is described. This method makes use of readily available 3‐nitroindoles …

Molecule isomerism modulates the diradical properties of stable singlet diradicaloids

JE Barker, JJ Dressler… - Journal of the …, 2019 - ACS Publications
Inclusion of quinoidal cores in conjugated hydrocarbons is a common strategy to modulate
the properties of diradicaloids formed by aromaticity recovery within the quinoidal unit. Here …

Higher order π-conjugated polycyclic hydrocarbons with open-shell singlet ground state: Nonazethrene versus nonacene

R Huang, H Phan, TS Herng, P Hu… - Journal of the …, 2016 - ACS Publications
Higher order acenes (ie, acenes longer than pentacene) and extended zethrenes (ie,
zethrenes longer than zethrene) are theoretically predicted to have an open-shell singlet …

Monoradicals and Diradicals of Dibenzofluoreno[3,2-b]fluorene Isomers: Mechanisms of Electronic Delocalization

H Hayashi, JE Barker… - Journal of the …, 2020 - ACS Publications
The preparation of a series of dibenzo-and tetrabenzo-fused fluoreno [3, 2-b] fluorenes is
disclosed, and the diradicaloid properties of these molecules are compared with those of a …

Role of a singlet diradical character in carbon nanomaterials: a novel hot spot for efficient nonlinear optical materials

S Muhammad, M Nakano, AG Al-Sehemi, Y Kitagawa… - Nanoscale, 2016 - pubs.rsc.org
Carbon atoms have the potential to produce a variety of fascinating all-carbon structures
with amazing electronic and mechanical properties. Over the last few decades, several …

Isomeric dibenzooctazethrene diradicals for high-performance air-stable organic field-effect transistors

C Zong, S Yang, Y Sun, L Zhang, J Hu, W Hu, R Li… - Chemical …, 2022 - pubs.rsc.org
Realizing both high-performance and air-stability is key to advancing singlet-diradical-based
semiconductors to practical applications and realizing their material potential associated …