Geometry & MOs
Info
ID: |
84888 |
PubChem CID: |
49870568 |
Reduced: |
NC54H96 (1) |
Stoich.: |
AB54C96 (1) |
Weight, g/mol: |
1078.816048 |
ΔHf, kcal/mol: |
9.79 |
Dipole, Da: |
0.58 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.750848 |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[bis(carboxymethyl)amino]-6-[[2-[1,3-bis(pentacosa-10,12-diynoxy)propan-2-yloxy]acetyl]amino]hexanoic acid