Shining light on inverted singlet–triplet emitters

M Bedogni, D Giavazzi, F Di Maiolo… - Journal of Chemical …, 2023 - ACS Publications
The inversion of the lowest singlet and triplet excited states, observed in several triangle-
shaped organic molecules containing conjugated carbon and nitrogen atoms, is an …

Resolution of Expanded Porphyrinoids: A Path to Persistent Chirality and Appealing Chiroptical Properties

P Han, M Han, JL Sessler, C Lei - Chemistry–A European …, 2023 - Wiley Online Library
Chirality is a fundamental characteristic of nature. Expanded porphyrinoids and their
analogues offer an attractive platform for delving into the intricacies of chirality. Expanded …

4-Diphenylamino-phenyl substituted pyrazine: nonlinear optical switching by protonation

L Xu, H Zhu, G Long, J Zhao, D Li, R Ganguly… - Journal of Materials …, 2015 - pubs.rsc.org
Through the integration of a 4-diphenylamino-phenyl unit with a pyrazine segment, a series
of novel organic conjugated molecules with different spacers and shapes have been …

3,6-Carbazoylene Octaphyrin (1.0.0.0.1.0.0.0) and Its Bis-BF2 Complex

H Chen, X Shi, Y Lun, Y Xu, T Lu, Z Duan… - Journal of the …, 2022 - ACS Publications
3, 6-Carbazole precursors were used to prepare an octaphyrin. The conformation and
electronic structure of the system could be modulated through trifluoroacetate (TFA) …

Strong two-photon absorption and ultrafast dynamics of meso-functionalized “push–pull” trans-A 2 BC porphyrins

S Kumar, JN Acharyya, D Banerjee, VR Soma… - Dalton …, 2021 - pubs.rsc.org
A new series of “push–pull” meso-substituted trans-A2BC porphyrins, where A= mesityl, B=
phenothiazine (push) and C= o/p-nitrophenyl moiety (pull) and M= 2H, Ni (II), Cu (II), and Zn …

Aromaticity–photovoltaic property relationship of triphenylamine-based D-π-A dyes: leads from DFT calculations

R Venkatraman, SVK Panneer… - The Journal of …, 2020 - ACS Publications
D-π-A-based dyes find a wide range of applications in molecular electronics and
photovoltaics in general and dye-sensitized solar cells (DSSC) in particular. We speculated …

Singlet–Triplet Inversion in Triangular Boron Carbon Nitrides

M Bedogni, F Di Maiolo - Journal of Chemical Theory and …, 2024 - ACS Publications
The discovery of singlet–triplet (ST) inversion in some π-conjugated triangle-shaped boron
carbon nitrides is a remarkable breakthrough that defies Hund's first rule. Deeply rooted in …

Turning on Organic Radical Emitters

M Dubbini, F Bonvini, L Savi… - The Journal of Physical …, 2024 - ACS Publications
Radical emitters have attracted considerable interest because of their potential to surpass
the limitations of singlet emitters due to spin statistics, thereby revolutionizing organic LEDs …

Correlated electronic properties of a graphene nanoflake: coronene

S Prodhan, S Mazumdar, S Ramasesha - Molecules, 2019 - mdpi.com
We report studies of the correlated excited states of coronene and substituted coronene
within the Pariser–Parr–Pople (PPP) correlated π-electron model employing the symmetry …

1, 4-Phenylene-Incorporated Decaphyrin (1.0. 1.0. 0.1. 0.1. 0.0): Synthesis, Structure, and Topological Chirality

Y Zheng, X Wang, H Chen, T Lu, Z Duan, C Lei - Organic Letters, 2022 - ACS Publications
Expanded porphyrins represent emerging structures in realizing topological chirality;
however, their inherent flexibility has hampered the effective chiral resolution. Herein, we …