Geometry & MOs

Info

ID:	266990
PubChem CID:	103580324
Reduced:	BrClSN2C11H16 (1)
Stoich.:	ABCD2E11F16 (1)
Weight, g/mol:	305.95931
ΔH_f, kcal/mol:	19.15
Dipole, Da:	3.72
IP(EA), eV:	-8.62(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(thian-3-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC(CCSC)N(C)C1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations