Comparison between the structure–boiling point relationships with different descriptors for condensed benzenoids

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Abstract
We compare the structure–boiling point models for benzenoid hydrocarbons based on three distance descriptors (the detour index, the Wiener sum index and its variant) and two connectivity indices (the vertex- and edge-connectivity indices) with those based on the geometric distance indices. The conclusions of this study are that the best model is based on the edge-connectivity index and that the models based on the geometric distance indices are good but not as good as models based on the connectivity indices.

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