Energetics of neutral and deprotonated (Z)-cinnamic acid

We have performed a study of structural, thermochemical and thermophysical properties of the (Z)-cinnamic acid neutral molecule and its corresponding oxyanion (formed by deprotonation of the carboxylic group). The thermophysical study (heat capacities, temperature and enthalpy of fusion) was made by...

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Detalles Bibliográficos
Autores principales:	Dávalos, J.Z., Lima, C.F.R.A.C., Silva, A.M.S., Santos, L.M.N.B.F., Erra-Balsells, R., Salum, M.L.
Formato:	JOUR
Materias:	(Z)-cinnamic acid B3LYP EKM Enthalpies of formation G3 G4 Gas-phase acidity Computation theory Density functional theory Gases Mass spectrometry Molecules Positive ions Solutions Thermodynamic properties Cinnamic acids Gas-phase acidities Enthalpy
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_00219614_v95_n_p195_Davalos
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

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