Pa. Beckmann et al., METHYL REORIENTATION IN SOLID 3-ETHYLCHRYSENE AND 3-ISOPROPYLCHRYSENE, Solid state nuclear magnetic resonance, 12(4), 1998, pp. 251-256
We have measured the proton spin-lattice relaxation rate as a function
of temperature in polycrystalline 3-ethylchrysene at nuclear magnetic
resonance Larmor frequencies of 53.0 and 22.5 MHz and in polycrystall
ine 3-isopropylchrysene at 53.0, 22.5 and 8.50 MHz. The syntheses of t
hese new compounds are presented. The relatively large chrysene backbo
ne creates an ideal and unique environment for the alkyl groups such t
hat methyl group rotation is the only motion on the nuclear magnetic r
esonance Larmor frequency timescale over a large temperature range. Th
e relaxation rate data are interpreted in terms of the simplest possib
le dynamical model; that of random hopping for the methyl group(s), al
l of which are equivalent in the solid state. The barriers of 11-12 kJ
mol(-1) are typical for methyl groups in 'isolated' ethyl and isoprop
yl groups. (C) 1998 Elsevier Science B.V. All rights reserved.