Geometry & MOs
Info
ID: |
145193 |
PubChem CID: |
53476716 |
Reduced: |
NSiC17H17 (1) |
Stoich.: |
ABC17D17 (1) |
Weight, g/mol: |
774.303831 |
ΔHf, kcal/mol: |
39.79 |
Dipole, Da: |
2.35 |
IP(EA), eV: |
-8.7(-0.14) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-[(3-methyl-4-piperidin-1-ylpiperidin-1-yl)methyl]-6-propan-2-ylsulfonyl-2-[3-(trifluoromethyl)phenyl]-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]quinoline-4-carboxamide