نوع مقاله : مقاله پژوهشی
عنوان مقاله English
نویسنده English
Repeatable molecular mechanics calculations are reported for the boat-chair isoforms of methylenecyclooctane. Ring inversion and pseudorotation in this molecule have been studied by molecular mechanics computational methods, and the activation free energy (AG) for these processes has been calculated to be 1.8 and 4.9 kcal/mol, respectively
