Geometry & MOs
Info
ID: |
326656 |
PubChem CID: |
126687955 |
Reduced: |
IN2H7C9 (1) |
Stoich.: |
AB2C7D9 (1) |
Weight, g/mol: |
683.291491 |
ΔHf, kcal/mol: |
73.35 |
Dipole, Da: |
4.3 |
IP(EA), eV: |
-9.26(-1.22) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(8S,11S,14S)-14-[[2-[[(2R)-2-[[2-[acetyl(methyl)amino]-3-aminopropanoyl]amino]propanoyl]amino]acetyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9,12-diazatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid