Geometry & MOs

Info

ID:	202795
PubChem CID:	79728268
Reduced:	ClFON2C9H10 (1)
Stoich.:	ABCD2E9F10 (1)
Weight, g/mol:	254.008075
ΔH_f, kcal/mol:	-68.16
Dipole, Da:	1.34
IP(EA), eV:	-8.78(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chloro-3-fluoropyridin-2-yl)sulfanylaniline

Drug info:

PubChemData

Smile

C1CN(CC1O)C2=C(C=C(C=N2)Cl)F

DOS

IR

Vibrations