Geometry & MOs
Info
ID: |
230919 |
PubChem CID: |
87572249 |
Reduced: |
SN2O2F3C9H11 (1) |
Stoich.: |
AB2C2D3E9F11 (1) |
Weight, g/mol: |
967.459225 |
ΔHf, kcal/mol: |
-200.95 |
Dipole, Da: |
3.73 |
IP(EA), eV: |
-9.48(-0.9) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2S)-3-(2-amino-2-oxoethyl)-2-[2-[(2R,5R)-5-[1-[(2S)-3-(2-amino-2-oxoethyl)-2-(carboxycarbamoyl)-3-methyl-2-bicyclo[2.2.2]octa-1(6),4,7-trienyl]pyrrolidin-2-yl]-1-[4-(6-morpholin-4-ylpyridin-3-yl)phenyl]pyrrolidin-2-yl]pyrrolidin-1-yl]-3-methylbicyclo[2.2.2]octa-1(6),4,7-triene-2-carbonyl]carbamic acid