Journal article
A TDDFT description of the low-energy excited states of copper and zinc metalloenediynes
Chemical communications (Cambridge, England), Vol.9(23), pp.2876-2877
12/07/2003
Handle:
https://hdl.handle.net/2376/101478
PMID: 14680219
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 pi systems.
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Details
- Title
- A TDDFT description of the low-energy excited states of copper and zinc metalloenediynes
- Creators
- Aurora E Clark - Department of Chemistry, Indiana University, Bloomington, IN, USAErnest R DavidsonJeffrey M Zaleski
- Publication Details
- Chemical communications (Cambridge, England), Vol.9(23), pp.2876-2877
- Academic Unit
- Chemistry, Department of
- Publisher
- England
- Grant note
- R01 GM62541-01A1 / NIGMS NIH HHS
- Identifiers
- 99900546640301842
- Language
- English
- Resource Type
- Journal article