Geometry & MOs
Info
ID: |
310604 |
PubChem CID: |
126583659 |
Reduced: |
O2N3C9H13 (1) |
Stoich.: |
A2B3C9D13 (1) |
Weight, g/mol: |
529.116223 |
ΔHf, kcal/mol: |
4.12 |
Dipole, Da: |
5.31 |
IP(EA), eV: |
-8.16(-0.99) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
N-[3-[(1R,5R,6S)-3-amino-2,2,5-trimethyl-1-oxo-1lambda6-thia-4,9-diazabicyclo[4.3.0]nona-1(9),3-dien-5-yl]-4-fluorophenyl]-3-chloro-5-(difluoromethoxy)pyridine-2-carboxamide