Geometry & MOs

Info

ID:	267616
PubChem CID:	103583010
Reduced:	BrClOSN3H7C12 (1)
Stoich.:	ABCDE3F7G12 (1)
Weight, g/mol:	313.92801
ΔH_f, kcal/mol:	55.91
Dipole, Da:	3.2
IP(EA), eV:	-8.71(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-3-chloropyridin-2-yl)sulfanylaniline

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1N)N=C(O2)SC3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations