H. Muller et al., beta(CO)-(ET)(2)I-3: Co-existence of ordered beta-(ET)(2)I-3 (T-c approximate to 8 K) and disordered beta-(ET)(2)I-3 (T-c approximate to 2 K), SYNTH METAL, 120(1-3), 2001, pp. 737-738
The crystal structures of beta (CO)-(ET)(2)I-3 were determined at temperatu
res of 293, 200, 130, 100, and 35 K from X-ray single crystal diffraction d
ata. At 293 K, one ethylene group of the ET cations is disordered with the
eclipsed conformation prevailing over the staggered conformer; at 200 K the
occupancies of both arrangements are equal. Upon cooling to 130 K and belo
w, about 60 % of the ethylene groups adopt a staggered conformation, thus p
roviding evidence for a temperature-induced, partial ordering process.