Geometry & MOs
Info
ID: |
448124 |
PubChem CID: |
135288648 |
Reduced: |
O2F3N3C16H16 (1) |
Stoich.: |
A2B3C3D16E16 (1) |
Weight, g/mol: |
830.588113 |
ΔHf, kcal/mol: |
-213.09 |
Dipole, Da: |
4.82 |
IP(EA), eV: |
-9.78(-1.12) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-2-[[(2R,3R)-3-methoxy-3-[(2S)-1-[(3R,4S,5S)-3-methoxy-5-methyl-4-[methyl-[(2S)-3-methyl-2-[[(2S)-3-methyl-2-[methyl-[(2S)-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methylpropyl]amino]-3-phenylpropanoic acid