Geometry & MOs

Info

ID:	267563
PubChem CID:	103582719
Reduced:	BrClNSO2H5C7 (1)
Stoich.:	ABCDE2F5G7 (1)
Weight, g/mol:	288.99814
ΔH_f, kcal/mol:	-23.31
Dipole, Da:	5.15
IP(EA), eV:	-10.24(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-3-chloropyridin-2-yl)piperidin-4-amine

Drug info:

PubChemData

Smile

C=CS(=O)(=O)C1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations