Geometry & MOs
Info
ID: |
138549 |
PubChem CID: |
52384192 |
Reduced: |
FNOSC15H25 (1) |
Stoich.: |
ABCDE15F25 (1) |
Weight, g/mol: |
285.156264 |
ΔHf, kcal/mol: |
-76.6 |
Dipole, Da: |
1.11 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.132586 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R)-2-[(4-fluorophenyl)methyl-(3-methylsulfanylpropyl)amino]butan-1-ol