Application of Graph Theory to Some Thermodynamic Properties and Topological Indices

Author(s):

H.Aghaie* , M.Monajjemi , and F.Shafiei

Message:
Article Type:
Research/Original Article (بدون رتبه معتبر)
Abstract:
The relationship between the Randic , Wiener, Hosoya , Balaban, Schultz indices, Harary numbers andDistance matrix to enthalpies of formation (Airf), heat capacity, (Cp) , enthalpies of combustion (AH °c ),enthalpy of vaporization (AH °vap) and normal boiling points (bpK)of C2 C10 normal alkanes isrepresented
Keywords:

QSAR , QSPR , Topological indices , Alkanes , Graph Theory , Molecular structure

Language:
English
Published:
Journal of Physical and Theoretical Chemistry, Volume:3 Issue: 3, Autumn 2006
Pages:
39 to 52
https://www.magiran.com/p2019261