The Journal of Physical Chemistry

Structural and Thermochemical Properties of Hydroxymethyl (CH2OH) Radicals and Cations Derived from Observations of B̃ 2A'(3p)← X̃ 2A''Electronic …

RD Johnson, JW Hudgens

Index: Boehland, T.; Temps, F.; Wagner, H. Gg. Berichte der Bunsen-Gesellschaft, 1986 , vol. 90, p. 468 - 475

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Citation Number: 99

Abstract

... The experimental and ab initio results lead to improved heat capacities and entropies (S° 298.15 (CH 2 OH) = 244.170 ± 0.018 J (mol K) -1 ). Ab initio CBS-QCI/APNO calculations predict that Δ f H° 298.15 (CH 2 OH) = −18.4 ± 1.3 kJ mol -1 . Re-evaluation of photoionization ...