NBO and NICS analysis of the allylic rearrangements (the Cope and 3-aza-Cope rearrangements) of hexa-1,5-diene and N-vinylprop-2-en-1-amine: A DFT study

• Zahedi Ehsan,
• Ali-Asgari Safa,
• Keley Vahid

Affiliations

Zahedi Ehsan

Chemistry Department, Islamic Azad University, Shahrood Branch P.O.box 36155/133, Shahrood, Iran

Ali-Asgari Safa

Chemistry Department, Islamic Azad University, Shahrood Branch P.O.box 36155/133, Shahrood, Iran

Keley Vahid

Chemistry Department, Shahrood University of Technology, P.O.box 316, Shahrood, Iran