The Journal of Physical Chemistry A
Stabilities, excitation energies, and dissociation reactions of CF2Cl2 and CF2Br2: Quantum chemical computations of heats of formation of Fluorinated methanes, …
MR Cameron, GB Bacskay
Index: Cameron, Melanie R.; Johns, Stephen A.; Metha, Gregory F.; Kable, Scott H. Physical Chemistry Chemical Physics, 2000 , vol. 2, # 11 p. 2539 - 2547
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Citation Number: 22
Abstract
The heats of formation of a range of chlorofluoro-, bromofluoro-, and iodofluoromethanes, methyls, and carbenes were computed using the Gaussian-3 (G3) and Gaussian-2 (G2) methods. From a number of computed isodesmic reaction enthalpies, the heats of formation
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