Geometry & MOs
Info
ID: |
233182 |
PubChem CID: |
87692903 |
Reduced: |
O9C63H104 (1) |
Stoich.: |
A9B63C104 (1) |
Weight, g/mol: |
436.00079 |
ΔHf, kcal/mol: |
-466.13 |
Dipole, Da: |
7.47 |
IP(EA), eV: |
-9.14(0.11) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-(2-iodopyrimidin-4-yl)-5-methyl-1-(2,2,2-trifluoroethyl)-6,7-dihydropyrrolo[3,2-c]pyridin-4-one