Studies on the Physical Properties of Alkanes Using Edge-adjacency Information Topological Index
CaiHuaNI, XianYuZENG, HeHUANG · 中国化学快报：英文版 · 2005
Edge-adjacency index and information topological index for 82 molecules of alkanes have been constructed and calculated. The topological indices were used to correlate with seven physical properties of the alkanes. Some empirical equations were obtained through regression.The regression and calculation results show a good agreement of the topological indices and the properties.