PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
hypofluorous acid
1511 Hypofluorous acid
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ΔHf: -20.9 kcal/mol, REF: J. A. Pople, L. A. Curtiss, J. Chem. Phys. 90, 2833 (1989). Ref. gives -19.9 kcal/mol for calculated heat of formation of HOF at 0K.
Dipole: 2.2 Debye, REF: S. L. Rock, E. F. Pearson, E. H. Appleman, C. L. Norris, W. H. Flygare, J. Chem. Phys., 59, 3940 (1973).
PM7
Hypofluorous acid
D=2.23 H=-20.9 DR=RPAN1973 HR=PC1989
H 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
O 0.99498665 +1 0.0000000 +0 0.0000000 +0 1 0 0
F 1.42640156 +1 101.2091355 +1 0.0000000 +0 2 1 0