Research Article

Torsional Potential Energy Surfaces of Dinitrobenzene Isomers

Table 2

The effect of relaxing the scan constraints at the orthodinitrobenzene minimum energy conformation.

Orthodinitrobenzene bondsAverage original length (Å)Average final length (Å)

C-C1.3951.391
C-H1.0851.086
C-N1.4751.453
N-O1.2271.226