Geometry & MOs
Info
ID: |
445789 |
PubChem CID: |
135269567 |
Reduced: |
NO2C9H18 (1) |
Stoich.: |
AB2C9D18 (1) |
Weight, g/mol: |
420.325297 |
ΔHf, kcal/mol: |
-70.21 |
Dipole, Da: |
4.06 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.751118 |
Charge, e: |
0 |
Chem-info
IUPAC name:
2,6-dimethyl-4-[(4-methylphenyl)methyl]-1-[[3-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]piperazine