Published June 2014 | Version v1
Journal article

Can a simple ionic model provide useful enthalpies of formation values?

Description

Graphical abstract: - Highlights: • A simple model for the estimation of enthalpies of formation was tested. • The model proved to be reliable for the compounds under study. • Enthalpies of formation of unmeasured ionic liquids were determined. • The stability of lanthanide (II and III) halides was successfully accessed. - Abstract: A simple ionic model is revisited. The model starts with the calculation of lattice energy and thus the thermochemical radii of the ions. These radii allow the calculation of other lattice energies and through a Born–Haber cycle to obtain the enthalpy of formation. By using literature available for experimental data, the model was tested to see if it can provide reliable enthalpies of formation values. As presented in this contribution, the method only applies to binary compounds with both simple and complex ions. As examples of the usefulness of this approach, enthalpies of formation of unmeasured crystalline ionic liquids (Hmim+, C2mim+, C4mim+ and NH4+ families) and lanthanide (II) halides were determined. The latter ones were used to address the stability of lanthanide halides in states II and III

Availability note (English)

Available from http://dx.doi.org/10.1016/j.jct.2014.01.003

Additional details

Identifiers

DOI
10.1016/j.jct.2014.01.003;
PII
S0021-9614(14)00008-1;

Publishing Information

Journal Title
Journal of Chemical Thermodynamics
Journal Volume
73
Journal Page Range
p. 232-240
ISSN
0021-9614
CODEN
JCTDAF

INIS

Country of Publication
United Kingdom
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
46033402
Subject category
S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
Descriptors DEI
FORMATION HEAT; HALIDES; IONS; LIQUIDS; MOLTEN SALTS
Descriptors DEC
CHARGED PARTICLES; ENTHALPY; FLUIDS; HALOGEN COMPOUNDS; PHYSICAL PROPERTIES; REACTION HEAT; SALTS; THERMODYNAMIC PROPERTIES

Optional Information

Copyright
Copyright (c) 2014 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.