화학공학소재연구정보센터
Journal of Physical Chemistry, Vol.98, No.7, 1826-1829, 1994
Heat of Formation of Ch2Oh
The heat of formation of CH2OH at 298 K is determined to be -15.2 +/- 3.5 kJ/mol using high levels of theory. This is in good agreement with some recent experimental determinations. The assignment of the error bars is discussed in detail and compared with that assigned in previous theoretical calculations. The largest uncertainty arises from the calculation of the zero-point energy.