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Relationship of charge to antiaromaticity in bis-fluorenyl dications and fluorenyl monocations: experimental support for theoretical calculations

机译:双芴基和芴基单阳离子中电荷与抗芳香性的关系:为理论计算提供实验支持

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摘要

The antiaromaticity of fluorenyl cations is dependent on the magnitude of the charge of the system. Theoretical assessments of antiaromaticity and charge were supported by experimental NlMR chemical shifts. Delocalization was related to antiaromaticity, and evaluated through the standard deviation of the charges on carbons of the fluorenyl systems.
机译:芴基阳离子的抗芳香性取决于系统电荷的大小。抗芳香性和电荷的理论评估得到实验NlMR化学位移的支持。离域化与抗芳香性有关,并通过芴基系统碳上电荷的标准偏差进行评估。

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  • 来源
    《Chemical Communications》 |2012年第65期|p.8099-8101|共3页
  • 作者单位

    Department of Chemistry, Trinity University, San Antonio, TX 78212-7200, USA;

    Department of Chemistry, Trinity University, San Antonio, TX 78212-7200, USA,Department of Physical and Biological Sciences, 1215 Wilbraham Road, Springfield, MA 01119, USA;

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