Geometry & MOs
Info
ID: |
230998 |
PubChem CID: |
87572426 |
Reduced: |
SN2O3C6H14 (1) |
Stoich.: |
AB2C3D6E14 (1) |
Weight, g/mol: |
904.495944 |
ΔHf, kcal/mol: |
-143.79 |
Dipole, Da: |
1.07 |
IP(EA), eV: |
-10.09(0.32) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2S)-1-[(2S)-2-[6-[(2S,5S)-5-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]-1-[4-[2-methoxyethyl(methyl)amino]phenyl]pyrrolidin-2-yl]-1H-benzimidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamic acid