Geometry & MOs
Info
ID: |
438617 |
PubChem CID: |
135228361 |
Reduced: |
O2N3C12H17 (1) |
Stoich.: |
A2B3C12D17 (1) |
Weight, g/mol: |
1276.754344 |
ΔHf, kcal/mol: |
-22.53 |
Dipole, Da: |
3.26 |
IP(EA), eV: |
-9.49(-0.35) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[4-[[(2S)-2-[[(2S)-2-[[(2R)-2-acetamido-3-azidopropanoyl]amino]-3-methylbutanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl N-[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylcarbamate