Geometry & MOs
Info
ID: |
432367 |
PubChem CID: |
135172500 |
Reduced: |
F2N2O3C14H28 (1) |
Stoich.: |
A2B2C3D14E28 (1) |
Weight, g/mol: |
823.301573 |
ΔHf, kcal/mol: |
-245.8 |
Dipole, Da: |
5.61 |
IP(EA), eV: |
-8.44(1.31) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-1-[[5-chloro-4-[[3-[2-chloro-3-[(1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]-2-methylphenyl]methoxy]-2-[(2E,4E)-4-cyano-2-methyl-5-(methylideneamino)penta-2,4-dienoxy]phenyl]methyl]piperidine-2-carboxylic acid