Geometry & MOs

Info

ID:	340859
PubChem CID:	127263294
Reduced:	BrNNaO2H9C10 (1)
Stoich.:	ABCD2E9F10 (1)
Weight, g/mol:	192.022104
ΔH_f, kcal/mol:	-86.81
Dipole, Da:	7.47
IP(EA), eV:	-9.22(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloropyridin-3-yl)ethanamine;hydrochloride

Drug info:

PubChemData

Smile

C1CC(C1)(C2=NC=C(C=C2)Br)C(=O)[O-].[Na+]

DOS

IR

Vibrations