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STUDIES ON THE QUANTITATIVE RELATION BETWEEN THE BOILING POINTS OF CYCLOAKANE AND MOLECULAR STRUCTURE

Wang Ke

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Abstract

Based on the characteristics of molecular structure,the distance matrix and dyeing matrix are used to characterize the connectivity of the radicals in molecules,a method for calculating the boiling points of cycloalknes is developed.The calculated results show that the predicted boiling points agree wiht the experimental data satisfactorily,the mean relative deviation is 0.69% for 239 cycloalkanes(C 3 to C 42 ).

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What this paper is about

Based on the characteristics of molecular structure,the distance matrix and dyeing matrix are used to characterize the connectivity of the radicals in molecules,a method for calculating the boiling points of cycloalknes is developed.The calculated results show that the predicted boiling points agree wiht the experimental data satisfactorily,the mean relative deviation is 0.69% for 239 cycloalkanes(C 3 to C 42 ).

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Available abstract

Based on the characteristics of molecular structure,the distance matrix and dyeing matrix are used to characterize the connectivity of the radicals in molecules,a method for calculating the boiling points of cycloalknes is developed.The calculated results show that the predicted boiling points agree wiht the experimental data satisfactorily,the mean relative deviation is 0.69% for 239 cycloalkanes(C 3 to C 42 ).

Key concepts: Boiling, Boiling point, Matrix (chemical analysis), Molecule, Thermodynamics, Mathematics, Relative standard deviation, Statistical physics

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STUDIES ON THE QUANTITATIVE RELATION BETWEEN THE BOILING POINTS OF CYCLOAKANE AND MOLECULAR STRUCTURE — Research Paper | ScholarLens