Geometry & MOs
Info
ID: |
445420 |
PubChem CID: |
135266936 |
Reduced: |
NOC9H11 (1) |
Stoich.: |
ABC9D11 (1) |
Weight, g/mol: |
814.258134 |
ΔHf, kcal/mol: |
-28.99 |
Dipole, Da: |
3.59 |
IP(EA), eV: |
-9.29(-0.05) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
N-[7-[2-[1-[[(Z)-[(5Z)-5-(1-amino-2,2-difluoroethylidene)-2,2-difluorocyclopentylidene]carbamoyl]amino]-2-(3,5-difluorophenyl)ethyl]-6-(3-hydroxy-3-methylbut-1-ynyl)pyridin-3-yl]-4-chloro-1-methylindazol-3-yl]-2-(cyclopropylamino)acetamide