engleski

Modeling the stability of metal complexes with aromatic ligands using graph-theoretical method

Models for the prediction of stability constants of coordination compounds based of the valence connectivity index 3χv do not treat interactions with aromatic compounds explicitly, but in spite of this by introducing specific interactions (“bonds”) it is possible to overcome original imperfections of the models. In this contribution we presented our results on complexes of amino acids, tetrapeptides and heterocyclic aromatic ligands.

complex compounds; topological indices; regression models

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