Single-molecule-based white-light emissive organic solids with molecular-packing-dependent thermally activated delayed fluorescence
Y Zhang, Y Miao, X Song, Y Gao, Z Zhang… - The Journal of …, 2017 - ACS Publications
White-light-emitting single molecules have attracted broad attention because of their great
potential for use in flat-panel displays and future light sources. We report a unique molecule …
potential for use in flat-panel displays and future light sources. We report a unique molecule …
Prolific polymorph generator ROY in its liquid and glass: two conformational populations mirroring the crystalline-state distribution
5-Methyl-2-[(2-nitrophenyl) amino]-3-thiophenecarbonitrile, dubbed ROY for its numerous
crystal polymorphs of red, orange, and yellow colors, has been studied in its liquid and …
crystal polymorphs of red, orange, and yellow colors, has been studied in its liquid and …
Substitution and torsional effects on the energetics of homolytic N–H bond cleavage in diphenylamines
The systematic study of substituent effects and torsional deformation on the N–H bond
dissociation enthalpies (BDE) in diphenylamine (DPA) and 33 mono-, 33 di-and 22 …
dissociation enthalpies (BDE) in diphenylamine (DPA) and 33 mono-, 33 di-and 22 …
Energetic and reactivity properties of 9, 10-dihydroacridine and diphenylamine: A comparative overview
VLS Freitas, JRB Gomes, JF Liebman… - The Journal of Chemical …, 2017 - Elsevier
The purpose of this research was to determine the energetic and reactivity properties of
diphenylamine and 9, 10-dihydroacridine using computational methodologies. The …
diphenylamine and 9, 10-dihydroacridine using computational methodologies. The …
Conformational distribution of a prolific polymorph generator ROY in its liquid and glass
methyl-2-[(2-nitrophenyl) amino]-3-thiophenecarbonitrile, dubbed ROY for its numerous
crystal polymorphs (13) of red, orange, and yellow colors, has been studied in the liquid and …
crystal polymorphs (13) of red, orange, and yellow colors, has been studied in the liquid and …
Experimental and theoretical studies on the structural, spectroscopic and hydrogen bonding on 4-nitro-n-(2, 4-dinitrophenyl) benzenamine
G Subhapriya, S Kalyanaraman… - Journal of Molecular …, 2018 - Elsevier
Abstract Synthesized 4-nitro-N-(2, 4-dinitrophenyl) benzenamine (NDPBA) molecule was
confirmed applying the tool of NMR. Theoretical prediction addressed the NMR chemical …
confirmed applying the tool of NMR. Theoretical prediction addressed the NMR chemical …