MODELING BOILING POINTS OF ALKANE DERIVATIVES
DOI:
https://doi.org/10.24193/subbchem.2017.1.12Keywords:
Graph theory, MLR method, Alkane Derivatives.Abstract
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 other molecular descriptors.
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