Modeling Boiling Points of Alkane Derivatives
Esmat Mohammadinasab · Studia Universitatis Babeș-Bolyai Chemia · 2017
Relationship between the boiling points of a series of alkanes and some topological indices and geometrical descriptors is investigated using the multi linear regression MLR method.The results revealed that Wiener, Randić and volume descriptors play a more important role in the description of boiling points of alkanes, in comparison to the other molecular descriptors.