Geometry & MOs
Info
ID: |
54189 |
PubChem CID: |
14747249 |
Reduced: |
CCoOSN2 (1) |
Stoich.: |
ABCDE2 (1) |
Weight, g/mol: |
473.983642 |
ΔHf, kcal/mol: |
9.97 |
Dipole, Da: |
1.62 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.800561 |
Charge, e: |
0 |
Chem-info
IUPAC name:
5,11-bis(2-thiophen-3-ylethyl)-2,8-dithia-5,11-diazatricyclo[7.3.0.03,7]dodeca-1(9),3(7)-diene-4,6,10,12-tetrone