Geometry & MOs
Info
ID: |
445485 |
PubChem CID: |
135267363 |
Reduced: |
NF2C3H4 (2) |
Stoich.: |
AB2C3D4 (2) |
Weight, g/mol: |
826.13632 |
ΔHf, kcal/mol: |
-170.23 |
Dipole, Da: |
2.53 |
IP(EA), eV: |
-9.06(0.0) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[(4S,5S)-6,6-difluoro-4-iodo-5-methyl-3-(trifluoromethyl)-4,5-dihydrocyclopenta[c]pyrazol-1-yl]-N-[(1S)-2-(3,5-difluorophenyl)-1-[2-(3-hydroxy-3-methylbut-1-ynyl)-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2,3-dihydropyridin-6-yl]ethyl]acetamide