Geometry & MOs
Info
ID: |
227307 |
PubChem CID: |
87561166 |
Reduced: |
ClF3H8C17 (1) |
Stoich.: |
AB3C8D17 (1) |
Weight, g/mol: |
936.274638 |
ΔHf, kcal/mol: |
-107.54 |
Dipole, Da: |
5.62 |
IP(EA), eV: |
-9.0(-1.73) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(E)-but-2-enedioic acid;[1-[1-(5-fluoro-2-methylphenyl)-5-pyridin-3-ylsulfonylpyrazol-3-yl]-3,3-dimethylbutan-2-yl]carbamic acid;1-[1-(5-fluoro-2-methylphenyl)-5-pyridin-3-ylsulfonylpyrazol-3-yl]-N-methylmethanamine