| Title: |
Regio- and conformational isomerization critical to design of efficient thermally-activated delayed fluorescence emitters. |
| Authors: |
Etherington, MK; Franchello, F; Gibson, J; Northey, T; Santos, J; Ward, JS; Higginbotham, HF; Data, P; Kurowska, A; Dos, Santos PL; Graves, DR; Batsanov, AS; Monkman, AP |
| Publication Year: |
2017 |
| Collection: |
Lancaster University: Lancaster Eprints |
| Description: |
Regio- and conformational isomerization are fundamental in chemistry, with profound effects upon physical properties, however their role in excited state properties is less developed. Here two regioisomers of bis(10H-phenothiazin-10-yl)dibenzo[b,d]thiophene-S,S-dioxide, a donor–acceptor–donor (D–A–D) thermally-activated delayed fluorescence (TADF) emitter, are studied. 2,8-bis(10H-phenothiazin-10-yl)dibenzo[b,d]thiophene-S,S-dioxide exhibits only one quasi-equatorial conformer on both donor sites, with charge-transfer (CT) emission close to the local triplet state leading to efficient TADF via spin-vibronic coupling. However, 3,7-bis(10H-phenothiazin-10-yl)dibenzo[b,d]thiophene-S,S-dioxide displays both a quasi-equatorial CT state and a higher-energy quasi-axial CT state. No TADF is observed in the quasi-axial CT emission. These two CT states link directly to the two folded conformers of phenothiazine. The presence of the low-lying local triplet state of the axial conformer also means that this quasi-axial CT is an effective loss pathway both photophysically and in devices. Importantly, donors or acceptors with more than one conformer have negative repercussions for TADF in organic light-emitting diodes. |
| Document Type: |
article in journal/newspaper |
| Language: |
unknown |
| ISSN: |
2041-1723 |
| Relation: |
Etherington, MK and Franchello, F and Gibson, J and Northey, T and Santos, J and Ward, JS and Higginbotham, HF and Data, P and Kurowska, A and Dos, Santos PL and Graves, DR and Batsanov, AS and Monkman, AP (2017) Regio- and conformational isomerization critical to design of efficient thermally-activated delayed fluorescence emitters. Nature Communications, 8: 14987. ISSN 2041-1723 |
| Availability: |
https://eprints.lancs.ac.uk/id/eprint/193714/ |
| Accession Number: |
edsbas.6B3B70B8 |
| Database: |
BASE |