Journal
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
Volume -, Issue 23, Pages 3657-3664Publisher
WILEY-V C H VERLAG GMBH
DOI: 10.1002/ejic.201402495
Keywords
EPESS; Phosphorescence; Density functional calculations; Pi interactions; Iridium
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Funding
- Natural Sciences and Engineering Research Council (NSERC) of Canada
- Leverhulme Trust
- National Interuniversity Consortium of Materials Science and Technology (INSTM)
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A new mechanism for enhanced phosphorescence emission in the solid state (EPESS) in cyclometallated Ir complexes with the general formula [Ir((CN)-N-boolean AND)(2)((NO)-O-boolean AND)] involving distortion of the six-membered chelate ring of the ancillary ligand is proposed. Photophysical and computational studies show that neither pi-stacking nor restricted rotation cause the observed EPESS in these complexes and that ligand distortions in the triplet excited state are responsible for EPESS
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