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    Please use this identifier to cite or link to this item: https://ir.lib.ncu.edu.tw/handle/987654321/101236


    Title: Reaction of an iron(IV) nitrido complex with cyclohexadienes: Cycloaddition and hydrogen-atom abstraction
    Authors: 李韋宗;Lee, Wei-Tsung;Juarez, Ruth A;Scepaniak, Jeremiah J;Muñoz, Salvador B;Dickie, Diane A;Wang, Haobin;Smith, Jeremy M
    Contributors: 理學院化學學系
    Keywords: Cyclization;Cycloaddition;Cyclohexenes - chemistry;Diels-Alder reactions;Electronic structure;Formations;Hydrogen - chemistry;Iron Compounds - chemical synthesis;Iron Compounds - chemistry;Isomerization;Mathematical analysis;Molecular Conformation;Nitrogen Compounds - chemistry;Radicals;Reaction mechanisms
    Date: 2014-08-18
    Issue Date: 2026-04-21 14:28:08 (UTC+8)
    Publisher: American Chemical Society;United States: American Chemical Society
    Abstract: 摘要: The iron­(IV) nitrido complex PhB­(MesIm)3FeN reacts with 1,3-cyclohexadiene to yield the iron­(II) pyrrolide complex PhB­(MesIm)3Fe­(η5-C4H4N) in high yield. The mechanism of product formation is proposed to involve sequential [4 + 1] cycloaddition and retro Diels–Alder reactions. Surprisingly, reaction with 1,4-cyclohexadiene yields the same iron-containing product, albeit in substantially lower yield. The proposed reaction mechanism, supported by electronic structure calculations, involves hydrogen-atom abstraction from 1,4-cyclohexadiene to provide the cyclohexadienyl radical. This radical is an intermediate in substrate isomerization to 1,3-cyclohexadiene, leading to formation of the pyrrolide product.
    其他題名: Inorg. Chem
    出版者: United States: American Chemical Society
    出版日期: 2014-08-18
    出處: Inorganic chemistry, 2014-08, Vol.53 (16), p.8425-8430
    資源來源: ACS Publications (Open Access)
    版權: Copyright © 2014 American Chemical Society
    版權: Copyright © 2014 American Chemical Society 2014 American Chemical Society
    識別號: ISSN: 0020-1669
    識別號: ISSN: 1520-510X
    識別號: EISSN: 1520-510X
    識別號: DOI: 10.1021/ic5010006
    識別號: PMID: 25068927
    Appears in Collections:[Department of Chemistry] journal & Dissertation

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