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All Journal EduChemia (Jurnal Kimia dan Pendidikan)
Saras Wati Banapon
Pendidikan Kimia, Universitas Khairun
Chemical Engineering, Chemistry & Bioengineering Chemistry Education Materials Science & Nanotechnology

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Reactivity of Cetophenone and Its Derivatives with Semi-Empirise Methods Parameterizedmodel 6 (PM6) Topan Setiawan; Saras Wati Banapon; Intan Sapsuha; Wahyu Yusup Duwila
EduChemia (Jurnal Kimia dan Pendidikan) Vol 7, No 1 (2022)
Publisher : Department of Chemical Education Faculty of Teacher Training and Education Universitas Su

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.30870/educhemia.v7i1.11844

Abstract

Cetophenone is used as an intermediate in the synthesis of flavones. In industry, Cetophenone is obtained as a by-product of the oxidation of ethyl benzene. The method used for modeling Cetophenone derivatives is a semi-empirical method using (PM6). The cetophenone derivative which has a larger energy difference is found in the compound 2-aceyiylisophyhaloitrile. The highest value of electronegativity and chemical hardness was found in the compound 2-aceyiylisophyhaloitrile and the greatest potential energy value was found in the compound 2-aceyiylisophyhaloitrile.
Co-Authors Intan Sapsuha Setiawan, Topan Wahyu Yusup Duwila