Complexing of cyclodextrins and their derivatives with fullerene С60

• Дата: 2007
• Автори: Mikhailenko, A. V., Strungar, A. V., Babiy, V. A., Prachenko, S. V., Kirpach, K. A.
• Формат: Стаття
• Мова: Російська
• Опубліковано: Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine 2007
• Онлайн доступ: https://surfacezbir.com.ua/index.php/surface/article/view/231
• Назва журналу: Surface

There has been investigated the impact of substituent’s nature on thermodynamic stability of “host-guest” complexes between С60 fullerene and some γ-cyclodextrin derivatives by ММ+ molecular dynamics method and PM3 semi-empirical quantum chemical method. There have been computed theoretical IR- and...