Enthalpies of sublimation and crystal lattice energies of 9-acridinamine and its derivatives

Citation
P. Storoniak et al., Enthalpies of sublimation and crystal lattice energies of 9-acridinamine and its derivatives, J THERM ANA, 54(1), 1998, pp. 183-187
Citations number
20
Categorie Soggetti
Spectroscopy /Instrumentation/Analytical Sciences
Journal title
JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY
ISSN journal
13886150 → ACNP
Volume
54
Issue
1
Year of publication
1998
Pages
183 - 187
Database
ISI
SICI code
1388-6150(1998)54:1<183:EOSACL>2.0.ZU;2-S
Abstract
Enthalpies of sublimation of acridine, 9-acridinamine, N-methyl-9-acridinam ine, 10-methyl-9-acridinimine, N,N-dimethyl-9-acridinamine and N-methyl-10- methyl-9-acridinimine were determined by fitting to thermogravimetric curve s with the Clausius-Clapeyron relationship. These values compare well with crystal lattice energies predicted theoretically as the sum of electrostati c, dispersive and repulsive interactions. Partial charges for these calcula tions were obtained on an ab initio level, while atomic parameters were tak en from literature.