The QSPR model of the enthalpies of formation from elements is suggested for a large group of the crystalline (T= 18°C) aquo and ammino complexes of the type [MLx]Haly. Statistical characteristics obtained for the one-parameter correlation relationship through the optimization of the so- called correlation weights of the local invariants of a molecular graph are as follows: r = 0.9992, s = 26 kJ/mol, and F = 37030 for the learning sample with n = 60; r = 0.9940, s = 66 kJ/mol, and F = 4640 for the control sample with n = 58.
|Number of pages||5|
|Journal||Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya|
|Publication status||Published - Aug 1998|
ASJC Scopus subject areas
- Inorganic Chemistry