Geometry & MOs
Info
ID: |
161916 |
PubChem CID: |
57393053 |
Reduced: |
NO3C17H17 (1) |
Stoich.: |
AB3C17D17 (1) |
Weight, g/mol: |
890.360199 |
ΔHf, kcal/mol: |
-62.79 |
Dipole, Da: |
4.18 |
IP(EA), eV: |
-8.72(-0.4) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(1S,2S)-1-[[(2S,4R)-1-[(2S)-2-(cyclopentyloxycarbonylamino)-3,3-dimethylbutanoyl]-4-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxypyrrolidine-2-carbonyl]amino]-2-ethenylcyclopropyl]-[(3-fluorophenyl)methyl]phosphinic acid