Geometry & MOs
Info
ID: |
85545 |
PubChem CID: |
49876708 |
Reduced: |
ClNSO3C5H11 (1) |
Stoich.: |
ABCD3E5F11 (1) |
Weight, g/mol: |
436.168434 |
ΔHf, kcal/mol: |
-118.03 |
Dipole, Da: |
5.5 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.755013 |
Charge, e: |
-2 |
Chem-info
IUPAC name:
1-(4-benzylpiperazin-1-yl)-3-(2-prop-2-enylphenoxy)propan-2-ol;dichloride