Skip to main content
. 2014 Mar 3;5(5):587–591. doi: 10.1021/ml500039g

Table 2. Mulliken Charges on the Indicated Positions Calculated by AM1 Methods for Representative Dinitroaromatic Scaffoldsa.

graphic file with name ml-2014-00039g_0008.jpg

Mulliken charges 9 19 24
1 0.24 0.17 0.22
2 0.26 0.10 0.22
3 0.26 0.11 0.22
a

The Mulliken charges are shown only for the numbered atoms for comparison purposes.