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Issue 23, 2003
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A TDDFT description of the low-energy excited states of copper and zinc metalloenediynes

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Abstract

Time-dependent density functional theory shows that the photoreactivities of copper and zinc metalloenediynes derive from multi-configurational excited states involving the enediyne and pyridine π systems.

Graphical abstract: A TDDFT description of the low-energy excited states of copper and zinc metalloenediynes

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Publication details

The article was received on 23 Jul 2003, accepted on 19 Aug 2003 and first published on 22 Oct 2003


Article type: Communication
DOI: 10.1039/B308633J
Citation: Chem. Commun., 2003,0, 2876-2877
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    A TDDFT description of the low-energy excited states of copper and zinc metalloenediynes

    A. E. Clark, E. R. Davidson and J. M. Zaleski, Chem. Commun., 2003, 0, 2876
    DOI: 10.1039/B308633J

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