Benzobisoxazole cruciforms: a tunable, cross-conjugated platform for the generation of deep blue OLED materials

R Chavez III, M Cai, B Tlach, DL Wheeler… - Journal of Materials …, 2016 - pubs.rsc.org
Four new cross-conjugated small molecules based on a central benzo [1, 2-d: 4, 5-d′]
bisoxazole moiety possessing semi-independently tunable HOMO and LUMO levels were …

Twenty years of exceptional success: The molecular education and research consortium in undergraduate computational chemistry (MERCURY)

GC Shields - International Journal of Quantum Chemistry, 2020 - Wiley Online Library
The molecular education and research consortium in undergraduate computational
chemistry (MERCURY) consortium, established in 2000, has contributed greatly to the …

Broadband optical limiting of a novel twisted tetrathiafulvalene incorporated donor–acceptor material and its Ormosil gel glasses

J Sun, B Yuan, X Hou, C Yan, X Sun, Z Xie… - Journal of Materials …, 2018 - pubs.rsc.org
To accomplish broadband optical limiting with high visible-light region (ca. 400–700 nm)
transmittance, as well as to satisfy the requirement of practical applications, a novel …

Two-dimensional, acene-containing conjugated polymers that show ratiometric fluorescent response to singlet oxygen

E Altınok, ZC Smith, SW Thomas III - Macromolecules, 2015 - ACS Publications
This paper describes two-dimensional conjugated poly (phenylene–ethynylene) s (PPEs)
linked to singlet oxygen-reactive diethynyltetracene units through phenylene–ethynylene …

Predicting Emission Wavelengths in Benzobisoxazole-Based OLEDs with Gradient Boosted Ensemble Models

S Tannir, Y Pan, N Josephs… - The Journal of …, 2024 - ACS Publications
We demonstrate the use of gradient-boosted ensemble models that accurately predict
emission wavelengths in benzobis [1, 2-d: 4, 5-d′] oxazole (BBO) based fluorescent …

Benzobisimidazole cruciform fluorophores

HTM Le, NS El-Hamdi, OS Miljanic - The Journal of Organic …, 2015 - ACS Publications
A series of 11 cross-conjugated cruciform fluorophores based on a benzobisimidazole
nucleus has been synthesized and characterized. Like in their previously reported …

Benzobisoxazole Cruciforms: A Cross‐conjugated Platform for Designing Tunable Donor/Acceptor Materials

AA Burney‐Allen, J Shaw, DL Wheeler… - Asian Journal of …, 2021 - Wiley Online Library
Four cross‐conjugated molecules based on the benzo [1, 2‐d: 4, 5‐d'] bisoxazole (BBO)
moiety have been synthesized from a common synthon. Theoretical studies indicated that …

Evaluating the Impact of Fluorination on the Electro-optical Properties of Cross-Conjugated Benzobisoxazoles

R Chavez III, L Diodati, DL Wheeler… - The Journal of …, 2019 - ACS Publications
Six 2, 4, 6, 8-tetrarylbenzo [1, 2-d: 4, 5-d′] bisoxazoles (BBOs) were synthesized: three
bearing phenyl substituents at the 2-and 6-positions and three bearing perfluorophenyl …

Rendering cross-conjugated azophenine derivatives emissive to probe the silent photophysical properties of emeraldine

H Lei, A Langlois, D Fortin, PL Karsenti… - Physical Chemistry …, 2017 - pubs.rsc.org
An azophenine derivative was synthesized by coupling truxene and azophenine via the
copper-free Sonagashira reaction using Pd2 (dba) 3 and As (PPh) 3 as catalysts. The crystal …

Vinazene end-capped acceptor-donor-acceptor type small molecule for solution-processed organic solar cells

M Chen, M Yi, J Yi, M Li, C Du, K Lin, W Tong, C Ma… - Organic …, 2017 - Elsevier
An acceptor-donor-acceptor (ADA) type molecule based on dioctyltertthiophene-benzo [1, 2-
b: 4, 5-b′] dithiophene-dioctyltertthiophene central donor and vinazene terminal acceptor …