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- W4310361470 endingPage "3740" @default.
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- W4310361470 abstract "One equivalent of methanol-d4 reacts with the iridium(III)-carbonato-NHC complex [Ir(Cp*)(NHC-theo)(O2CO)] [1] containing an N-heterocyclic carbene ligand with an N-tethered C8-iodotheophylline group (NHC-theo) to form the iridium(III) chelate complex [Ir(Cp*)(theophyllinato^NHC)I] [2] that bears a theophyllinato^NHC chelate ligand, an iodo ligand, and the pentamethylcyclopentadienyl ligand (Cp*). The methanol-d4 solvent is oxidized to formaldehyde-d2 that was identified by a detailed LC–MS study using the 2,4-dinitrophenylhydrazine (DNPH) method. A plausible rearrangement involving the unusual oxidative addition of the C8–I bond of the theophylline group to an iridium(III) center to give a seven-coordinate iridium(V) intermediate is supported by density functional theory calculations." @default.
- W4310361470 created "2022-12-09" @default.
- W4310361470 creator A5019474679 @default.
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- W4310361470 creator A5040389111 @default.
- W4310361470 creator A5075374352 @default.
- W4310361470 creator A5078239193 @default.
- W4310361470 date "2022-11-29" @default.
- W4310361470 modified "2023-10-07" @default.
- W4310361470 title "Methanol-Mediated Formation of an Iridium(III) NHC/Azolato Chelate Complex: An Experimental and Theoretical Study" @default.
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