Geometry & MOs

Info

ID:	267557
PubChem CID:	103582710
Reduced:	BrNSCl2C9H10 (1)
Stoich.:	ABCD2E9F10 (1)
Weight, g/mol:	298.89379
ΔH_f, kcal/mol:	8.47
Dipole, Da:	1.27
IP(EA), eV:	-9.02(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-2-(1-chloropropan-2-ylsulfanyl)pyridine

Drug info:

PubChemData

Smile

CC(CSC1=C(C=C(C=N1)Br)Cl)CCl

DOS

IR

Vibrations