Geometry & MOs
Info
ID: |
215759 |
PubChem CID: |
85085211 |
Reduced: |
NH5Cl23C31 (1) |
Stoich.: |
AB5C23D31 (1) |
Weight, g/mol: |
1445.760837 |
ΔHf, kcal/mol: |
-15.15 |
Dipole, Da: |
2.17 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.786032 |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-nitro-N-[4,6,10,12,14,16,20,22,24,40,42-undecahydroxy-56-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-27,41,43-trimethyl-26,56-dioxo-28-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyhexapentaconta-8,18,30,32,34,36,38,44,48,50,52,54-dodecaenyl]benzamide