Synthesis of N-Benzoyl-N’-(9,10-Dioxo-9,10-Dihydroanthacen-1-yl) Thioureas and Quantum-Chemical Analysis of the Reaction Passing

• DOI: 10.23939/chcht08.02.135
• Publication Date: 2018-11-08T13:15:57Z
• Authors: Maryna Stasevych; Viktor Zvarych; ; Rostyslav Musyano...; ; Volodymyr Novikov; ; Mykhailo Vovk
• Keywords: Quantum chemical; Quantum Chemistry; Nucleophilic Addition

Interaction of an order aminoanthraquinones with benzoylisothiocyanate resulting in the formation new N-benzoyl-N'-(9,10-dioxo-9,10-dihydroanthacen-1yl)-thioureas was investigated.Quantum-chemical calculations using Gaussian 03W and HyperChem 8 were carried out.On their basis nucleophilic addition to (charge control) confirmed.A probable mechanism suggested.Influence orthosubstituents on passing reaction explained.Values absolute hardness softness calculated.