Geometry & MOs
Info
ID: |
321180 |
PubChem CID: |
126665108 |
Reduced: |
SN2C7H19 (1) |
Stoich.: |
AB2C7D19 (1) |
Weight, g/mol: |
349.11873 |
ΔHf, kcal/mol: |
18.53 |
Dipole, Da: |
5.08 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.752536 |
Charge, e: |
0 |
Chem-info
IUPAC name:
6-[3-[3-(dimethylamino)propyl]imidazol-3-ium-1-yl]hexane-1-thiol;bromide