Adsorption of fluoride Quinone a grapheneflake: A theorical study
Publish Year: 1402
نوع سند: مقاله کنفرانسی
زبان: English
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شناسه ملی سند علمی:
NANOTEC07_037
تاریخ نمایه سازی: 11 مرداد 1403
Abstract:
Quinones are oxidized derivatives of aromatic compounds and are often readily made from reactive aromatic compoundswith electron-donating substituents such as phenols and catechols, which increase the nucleophilicity of the ring. The termquinone is also used more generally for a large class of compounds formally derived from aromatic quinones through thereplacement of some hydrogen atoms by other atoms or radicals. Considering the importance of quinone and the type ofsubstitution placed on quinone, in this article, the thermodynamic parameters and electromotive force of ۵ structures offluorinated quinone derivatives on graphene nanostructure were investigated by density function method, and the resultsshowed that the values of these parameters depend on substitution type. It means that as the number of fluorine substitutionsincreases, the values of thermodynamic parameters also increase.
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Authors
Zahra Mongashti
dept. Chemistry Yasouj University, Yasouj, Iran
Seyed Mohammad Azami
Chemistry Department Yasouj University, Yasouj, Iran