Geometry & MOs
Info
ID: |
441072 |
PubChem CID: |
135232999 |
Reduced: |
NO2F9H12C20 (1) |
Stoich.: |
AB2C9D12E20 (1) |
Weight, g/mol: |
595.171035 |
ΔHf, kcal/mol: |
-482.53 |
Dipole, Da: |
9.6 |
IP(EA), eV: |
-9.48(-1.44) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-N-[(1S)-1-(2-chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl]-1-(4-cyanopyridin-2-yl)-N-[(5-fluoropyridin-3-yl)methyl]-5-iminopyrrolidine-2-carboxamide