Geometry & MOs

Info

ID:	284960
PubChem CID:	104085831
Reduced:	OSF3N3C10H12 (1)
Stoich.:	ABC3D3E10F12 (1)
Weight, g/mol:	228.073262
ΔH_f, kcal/mol:	-164.34
Dipole, Da:	2.85
IP(EA), eV:	-9.5(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-(1-hydroxypropan-2-ylsulfanyl)benzenecarboximidamide

Drug info:

PubChemData

Smile

CC(CO)SC1=C(C=CC(=N1)C(F)(F)F)C(=N)N

DOS

IR

Vibrations