Geometry & MOs
Info
ID: |
146753 |
PubChem CID: |
53744273 |
Reduced: |
BrON6H12C14 (1) |
Stoich.: |
ABC6D12E14 (1) |
Weight, g/mol: |
1125.846453 |
ΔHf, kcal/mol: |
148.95 |
Dipole, Da: |
4.72 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.893582 |
Charge, e: |
0 |
Chem-info
IUPAC name:
1-[1-[3-[2-[2-(4-methylpiperazin-1-yl)ethoxy]-3-piperazin-1-ylpropoxy]-3-morpholin-4-yl-2-(2-piperazin-1-ylethoxy)propoxy]-2-(2-morpholin-4-ylethoxy)-3-piperidin-1-ylpropoxy]-2-(2-piperidin-1-ylethoxy)-1-(3-pyrrolidin-1-ylpropoxy)ethanol