Geometry & MOs
Info
ID: |
228719 |
PubChem CID: |
87565609 |
Reduced: |
F3O5C9H11 (1) |
Stoich.: |
A3B5C9D11 (1) |
Weight, g/mol: |
903.395562 |
ΔHf, kcal/mol: |
-377.86 |
Dipole, Da: |
4.45 |
IP(EA), eV: |
-11.51(-1.78) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2S)-3-benzyl-2-[2-(N-[1-[(2S)-3-benzyl-3-carbamoyl-2-(carboxycarbamoyl)-2-bicyclo[3.2.2]nona-1(7),5,8-trienyl]pyrrolidin-2-yl]anilino)pyrrolidin-1-yl]-3-carbamoylbicyclo[3.2.2]nona-1(7),5,8-triene-2-carbonyl]carbamic acid