Geometry & MOs
Info
ID: |
449826 |
PubChem CID: |
135301892 |
Reduced: |
N3C20H21 (1) |
Stoich.: |
A3B20C21 (1) |
Weight, g/mol: |
1106.462434 |
ΔHf, kcal/mol: |
104.31 |
Dipole, Da: |
1.82 |
IP(EA), eV: |
-8.2(-0.5) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
methyl N-[(2S)-1-[2-[[4-[(Z)-1-amino-3-iminoprop-1-enyl]-2,6-difluorophenyl]methyl]-2-[(2S,3S)-2-hydroxy-4-[4-[2-[6-[8-(oxetan-3-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]pyridin-3-yl]ethynyl]phenyl]-3-[[(2S)-4,4,4-trifluoro-2-(methoxycarbonylamino)-3,3-dimethylbutanoyl]amino]butyl]hydrazinyl]-4,4,4-trifluoro-3,3-dimethyl-1-oxobutan-2-yl]carbamate