Back to Features of PM6
|
|
DHf: 198.4 kcal/mol, REF: M. D. Harmony, V. W. Laurie, R. L. Kuczkowsky, R. H. Schwendeman, D. A. Ramsay, F. J. Lovas, W. J. Lafferty, A. G. Maki, J. Phys. Chem. Ref. Data 8, 3 (1979).
OPEN(2,3) MECI Boron dimer HR=HLKS1979 H=198.4 B 0.00000000 +0 0.0000000 +0 0.0000000 +0 0.0000 B 1.63668992 +1 0.0000000 +0 0.0000000 +0 1 0 0 0.0000