Geometry & MOs
Info
ID: |
169764 |
PubChem CID: |
75144658 |
Reduced: |
P3C5H9O14 (1) |
Stoich.: |
A3B5C9D14 (1) |
Weight, g/mol: |
2018.138184 |
ΔHf, kcal/mol: |
-667.1 |
Dipole, Da: |
6.46 |
IP(EA), eV: |
-11.41(-2.59) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[2-[2-[3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[hydroxy-[hydroxy(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenoxy)phosphoryl]oxyphosphoryl]oxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoylamino]-5-[[6-[2-(2-aminopropanoylamino)propanoylamino]-1-[[1-(1-carboxyethylamino)-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid