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- W3004838600 abstract "Abstract Incorporating tungsten into the N3 core of a N‐fused porphyrin (NFP; 1 ) affords high‐valent tungsten(VI)‐NFP complexes, WClO 2 ‐1 and 21‐chlorinated WClO 2 ‐3 . The X‐ray structure of WClO 2 ‐1 reveals a distorted octahedral geometry with sitting atop metal coordination. The absorption spectrum of WClO 2 ‐1 displays bathochromically shifted Q‐like bands beyond 1000 nm, indicating an inherently narrow HOMO‐LUMO energy gap. DFT calculations show that the degeneracy of the LUMO and LUMO+1 pair of 1 is significantly resolved by the tungsten(VI) coordination. Conclusively, magnetic circular dichroism (MCD) spectroscopy and cyclic voltammetry provide a rationale for the narrow HOMO‐LUMO energy gap in the “16‐electron” d 0 tungsten(VI)‐NFP complexes." @default.
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- W3004838600 date "2020-02-14" @default.
- W3004838600 modified "2023-09-27" @default.
- W3004838600 title "Tungsten(VI) Complex of N‐Fused Porphyrin Absorbing Near‐Infrared Light beyond 1000 nm" @default.
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- W3004838600 doi "https://doi.org/10.1002/asia.202000014" @default.
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