Geometry & MOs

Info

ID:	198724
PubChem CID:	79141968
Reduced:	FSN2O3C12H15 (1)
Stoich.:	ABC2D3E12F15 (1)
Weight, g/mol:	295.084242
ΔH_f, kcal/mol:	-161.15
Dipole, Da:	4.42
IP(EA), eV:	-8.79(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-[3-(4-fluorophenoxy)propylsulfanyl]aniline

Drug info:

PubChemData

Smile

CC(=O)NC(CSC1=CC(=C(C=C1)N)F)C(=O)OC

DOS

IR

Vibrations