Geometry & MOs
Info
ID: |
445429 |
PubChem CID: |
135267020 |
Reduced: |
FNC11H16 (1) |
Stoich.: |
ABC11D16 (1) |
Weight, g/mol: |
808.197013 |
ΔHf, kcal/mol: |
-57.63 |
Dipole, Da: |
2.86 |
IP(EA), eV: |
-8.69(0.31) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
N-[(1S)-1-[3-[4-chloro-3-(methanesulfonamido)-1-methylindazol-7-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)pyridin-2-yl]-2-(3,5-difluorophenyl)ethyl]-2-[(2S,5R)-10-cyano-6,6-difluoro-8,9-diazatricyclo[5.3.0.02,5]deca-1(7),9-dien-8-yl]acetamide