화학공학소재연구정보센터
Chemical Physics Letters, Vol.367, No.1-2, 186-192, 2003
Phase diagram and crystal phases of trans-1,3 butadiene probed by FTIR and Raman spectroscopy
In the present work the first spectroscopic data concerning solid butadiene are presented. FTIR and Raman spectra of solid trans-1,3 butadiene in the ordered phase I were recorded at atmospheric pressure down to 12 K. The FTIR technique was used to characterize the phase diagram of butadiene in the 0-7 GPa and 150-300 K pressure-temperature range. Besides phase I another solid phase (phase II), orientationally disordered, was found to be stable at pressures above 0.5 GPa between the liquid and the ordered phase I. A monoclinic C-2h(5) crystal structure with two molecules per cell sitting on C-i sites is proposed for phase I. (C) 2002 Elsevier Science B.V. All rights reserved.