Geometry & MOs
Info
ID: |
136089 |
PubChem CID: |
51976986 |
Reduced: |
OF3N3C15H21 (1) |
Stoich.: |
AB3C3D15E21 (1) |
Weight, g/mol: |
282.137315 |
ΔHf, kcal/mol: |
-175.2 |
Dipole, Da: |
7.52 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.786562 |
Charge, e: |
1 |
Chem-info
IUPAC name:
3-[6-chloro-2-[(1S)-1-hydroxyethyl]benzimidazol-1-yl]propyl-dimethylazanium