Geometry & MOs
Info
ID: |
432707 |
PubChem CID: |
135172843 |
Reduced: |
NOC14H25 (1) |
Stoich.: |
ABC14D25 (1) |
Weight, g/mol: |
968.563435 |
ΔHf, kcal/mol: |
-92.23 |
Dipole, Da: |
3.69 |
IP(EA), eV: |
-9.64(1.3) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-2-[[(2R,3R)-3-[(3S)-2-[(3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-[6-(2,5-dioxopyrrol-1-yl)hexanoyl-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]-6-methyl-2-azabicyclo[3.1.0]hexan-3-yl]-3-methoxy-2-methylpropanoyl]amino]-3-(2-fluorophenyl)propanoic acid