Geometry & MOs
Info
ID: |
425645 |
PubChem CID: |
135127118 |
Reduced: |
NOH4C5 (2) |
Stoich.: |
ABC4D5 (2) |
Weight, g/mol: |
1300.731877 |
ΔHf, kcal/mol: |
-10.85 |
Dipole, Da: |
3.92 |
IP(EA), eV: |
-10.47(-1.12) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
benzyl (3R,4R)-4-[(2S)-1-[(3R,5S)-4-[[(2S)-2-[[(2S)-2-[[4-[[(2S)-5-(carbamoylamino)-2-[[2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]-3-methylbutanoyl]amino]pentanoyl]amino]phenyl]methoxycarbonyl-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-4-methoxy-3-methyl-2-oxobutanoate