Far-infrared spectra have been measured for Cu-63 and Cu-65 isotope su
bstituted theophylline (Tp)-metal ion complexes: Cu(Tp)(2)(NH3)(2) . 2
H(2)O, Cu(Tp)(2)(NH3)(2), Cu(Tp)(2) . 2H(2)O and Cu(Tp)(2). In additio
n, spectrum of Cu(Tp)(2)(ND3)(2) . 2D(2)O has been recorded. Metal-the
ophylline, metal-ammine and water librational and translational modes
have been assigned based on observed isotope shifts and complex dehydr
ation effects. The copper-ammine vibrations have been found at 453 and
224 cm(-1), whereas the bis(theophyllinato)copper(II) modes have been
detected at 192 cm(-1) for Cu(Tp)(2)(NH3)(2) and presumably at about
170 cm(-1) for Cu(Tp)(2). (C) 1998 Elsevier Science B.V. All rights re
served.