Geometry & MOs

Info

ID:	267604
PubChem CID:	103582955
Reduced:	BrClOSN5H7C12 (1)
Stoich.:	ABCDE5F7G12 (1)
Weight, g/mol:	314.91203
ΔH_f, kcal/mol:	106.24
Dipole, Da:	5.75
IP(EA), eV:	-9.38(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N2C(=NN=N2)SC3=C(C=C(C=N3)Br)Cl)O

DOS

IR

Vibrations