Use of the international chemical identifier for constructing QSPR-model of normal boiling points of acyclic carbonyl substances

DOI10.1007/S10910-009-9574-9MaRDI QIDQ848159zbMATH OpenOpenAlexFDO

Authors Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati, Danuta Leszczynska, Jerzy Leszczynski

Publication date 2 March 2010

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-009-9574-9

zbMATH Keywords

tablesQSPRacyclic carbonyl compoundsInChInormal boiling point

Mathematics Subject Classification ID

Chemistry (92E99) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

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