An examination of the heats of formation
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J.S. Francisco; N.J. Abersold
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Article
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1991
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Elsevier Science
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English
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The heats of formation for CHsCO and CFsCO molecules have been determined using ab initio molecular orbital calculations from isodesmic schemes. The heat of formation for CHJCO has been calculated as -4.2 +2 kcal mol-', which is in good agreement with experiment and that for CF,CO as -139.9 f 2 kcal