Geometry & MOs
Info
ID: |
186764 |
PubChem CID: |
77479930 |
Reduced: |
NOH9C13 (1) |
Stoich.: |
ABC9D13 (1) |
Weight, g/mol: |
784.3479 |
ΔHf, kcal/mol: |
71.64 |
Dipole, Da: |
6.9 |
IP(EA), eV: |
-9.68(-1.56) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
methyl N-[1-[2-[5-[5-[4-[2-[1-[2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]-4H-pyrrolo[3,2-d][1,3]thiazol-2-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate