Geometry & MOs
Info
ID: |
401742 |
PubChem CID: |
135052396 |
Reduced: |
ON2S2C13H15 (1) |
Stoich.: |
AB2C2D13E15 (1) |
Weight, g/mol: |
363.001734 |
ΔHf, kcal/mol: |
9.17 |
Dipole, Da: |
4.94 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.850405 |
Charge, e: |
0 |
Chem-info
IUPAC name:
dimethylcarbamothioyl (1Z)-N-methylsulfonyloxy-3-nitrobenzenecarboximidothioate