Geometry & MOs
Info
ID: |
441330 |
PubChem CID: |
135234137 |
Reduced: |
O2N3C6H13 (1) |
Stoich.: |
A2B3C6D13 (1) |
Weight, g/mol: |
716.208725 |
ΔHf, kcal/mol: |
-79.46 |
Dipole, Da: |
1.32 |
IP(EA), eV: |
-9.04(0.3) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[5-(3,3-difluoroazetidin-1-yl)pyridin-2-yl]-N-[5-[(1S,3S)-3-[5-[[2-[[5-(3,3-difluoroazetidin-1-yl)pyridin-2-yl]methyl]oxiran-2-yl]amino]-1,3,4-thiadiazol-2-yl]cyclohexyl]-1,3,4-thiadiazol-2-yl]acetamide