SIMPLIFIED FORMULA FOR THE (1)A(1)REVERSIBLE-ARROW-T-5(2) SPIN TRANSITION-TEMPERATURE IN FE(II) COMPLEXES

Authors
Citation
Va. Varnek, SIMPLIFIED FORMULA FOR THE (1)A(1)REVERSIBLE-ARROW-T-5(2) SPIN TRANSITION-TEMPERATURE IN FE(II) COMPLEXES, Journal of structural chemistry, 35(6), 1994, pp. 834-841
Citations number
18
Categorie Soggetti
Chemistry Inorganic & Nuclear","Chemistry Physical
ISSN journal
00224766
Volume
35
Issue
6
Year of publication
1994
Pages
834 - 841
Database
ISI
SICI code
0022-4766(1994)35:6<834:SFFT(S>2.0.ZU;2-#
Abstract
A formula relating the (1)A(1) reversible arrow T-5(2) spin transition temperature (T-c) in Fe(II) complexes to characteristics of the compo unds is derived. With certain assumptions, T-c is determined by the sp litting parameter Delta(LS) of e(g)- and t(2g)-orbitals for the low-sp in complexes and by the frequency ratio of normal vibrations of the lo w- and high-spin phases. Fbr the group of compounds possessing spilt t ransitions, the values of Delta(LS) are found and analyzed Correlation s between T-c and Delta(LS) are established; the values of the change in the probability of the Mossbauer effect are correlated with those o f entropy of spin transition. The correlations are substantiated. It i s concluded that for mononuclear Fe(II) complexes possessing sharp spi n transitions, T-c may not be significantly higher than for Fe(Phy)(2) (BF4)(2)(T-c = 282 K).