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Theoretical Study on the Aliphatic C-H Bond Activation by a Mononuclear Manganese(III) Iodosylbenzene Complex
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- Title
- Theoretical Study on the Aliphatic C-H Bond Activation by a Mononuclear Manganese(III) Iodosylbenzene Complex
- Issued Date
- 2021-07
- Citation
- Jeong, Donghyun. (2021-07). Theoretical Study on the Aliphatic C-H Bond Activation by a Mononuclear Manganese(III) Iodosylbenzene Complex. Bulletin of the Korean Chemical Society, 42(7), 1033–1036. doi: 10.1002/bkcs.12300
- Type
- Article
- Author Keywords
- Model chemistry ; Metal‐ ; iodosylarene ; C ; H bond activation
- Keywords
- MULTIPLE ACTIVE OXIDANTS ; OXYGEN-ATOM TRANSFER ; ALKANE HYDROXYLATION ; HYPERVALENT IODINE ; 2-STATE REACTIVITY ; NONHEME ; IODOSYLARENE ; ADDUCTS ; OXO ; IRON(III)
- ISSN
- 0253-2964
- Abstract
-
We present a theoretical study on the aliphatic C-H bond activation of cyclohexadiene (CHD) by a mononuclear manganese(III) iodosylbenzene complex [Mn-III(TBDAP)(OIPh)(OH)](2+) (1). The results suggest that the first step is overall characterized as hydride transfer. However, at the more fundamental level, this step consists of a hydrogen atom transfer and a subsequent electron transfer. © 2021 Korean Chemical Society, Seoul & Wiley-VCH GmbH
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- Publisher
- John Wiley and Sons Inc
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