Geometry & MOs
Info
ID: |
121482 |
PubChem CID: |
50770030 |
Reduced: |
O2S2N3H21C25 (1) |
Stoich.: |
A2B2C3D21E25 (1) |
Weight, g/mol: |
468.048146 |
ΔHf, kcal/mol: |
22.95 |
Dipole, Da: |
5.76 |
IP(EA), eV: |
-8.51(-1.29) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
12-[(3-chlorophenyl)methylsulfanyl]-8-[(2-methoxyphenyl)methyl]-5-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,9,11-tetraen-7-one