Geometry & MOs
Info
ID: |
195304 |
PubChem CID: |
78671012 |
Reduced: |
O2N4C25H35 (1) |
Stoich.: |
A2B4C25D35 (1) |
Weight, g/mol: |
383.197082 |
ΔHf, kcal/mol: |
-26.01 |
Dipole, Da: |
5.5 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.757131 |
Charge, e: |
1 |
Chem-info
IUPAC name:
2,3-dihydro-1-benzofuran-2-yl-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone