Electron Density of Phenoxyl and 4-Vinylphenoxyl

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A Computational Analysis of Electron Density of Phenoxyl and 4-Vinylphenoxyl

Phenoxyl

4-Vinylphenoxyl

Radical Frontier Density Diagram of Phenoxyl

Radical Frontier Density Diagram of 4-Vinylphenoxyl

Simulated ESR Spectrum of Phenoxyl

Simulated ESR Spectrum of 4-Vinylphenoxyl

Calculations

Structure	Energy in Hartree	Run Time
Phenoxyl	-306.921557301	10:53
4-Vinylphenoxyl	-384.34962674	33:31

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