Journal
INORGANIC CHEMISTRY
Volume 62, Issue 10, Pages 4284-4290Publisher
AMER CHEMICAL SOC
DOI: 10.1021/acs.inorgchem.2c04407
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Metal complexes with a 3d6 electron count are being considered as alternatives to 4d6-based photosensitizers, emitters, or photoredox catalysts. Fe(II) potential emitters based on strongly donating ligand sets have been proposed, which undergo oxidation to their 3d5 species. The geometry and electronic structure of 2LMCT states are investigated in this study.
Metal complexes with a 3d6 electron count are emerging as an alternative to 4d6-based photosensitizers, emitters, or photoredox catalysts. In recent years, several Fe(II) potential emitters have been proposed, based on strongly donating ligand sets. Those tend to facilitate oxidation to their 3d5 species, whose photophysics is based on low-lying ligand-to-metal charge-transfer (LMCT) states. The geometry and electronic structure of 2LMCT states are unveiled in this work.
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