Geometry & MOs
Info
ID: |
326605 |
PubChem CID: |
126687869 |
Reduced: |
N3C11H21 (1) |
Stoich.: |
A3B11C21 (1) |
Weight, g/mol: |
851.479291 |
ΔHf, kcal/mol: |
18.7 |
Dipole, Da: |
4.67 |
IP(EA), eV: |
-9.17(0.57) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(8S)-14-[[2-[[2-[[(2R)-2-[hexadecanoyl(methyl)amino]-3-hydroxypropanoyl]amino]acetyl]amino]acetyl]-methylamino]-3,18-dihydroxy-10,13-dioxo-9,12-diazatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxamide