Geometry & MOs

Info

ID:	198725
PubChem CID:	79141972
Reduced:	NOSF2C15H15 (1)
Stoich.:	ABCD2E15F15 (1)
Weight, g/mol:	240.019119
ΔH_f, kcal/mol:	-89.35
Dipole, Da:	4.19
IP(EA), eV:	-8.29(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-(1,3-thiazol-4-ylmethylsulfanyl)aniline

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OCCCSC2=CC(=C(C=C2)N)F)F

DOS

IR

Vibrations