Geometry & MOs

Info

ID:	209161
PubChem CID:	80633244
Reduced:	BrN3O3H10C12 (1)
Stoich.:	AB3C3D10E12 (1)
Weight, g/mol:	267.173548
ΔH_f, kcal/mol:	27.77
Dipole, Da:	6.94
IP(EA), eV:	-9.64(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridin-3-yl]ethanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)[N+](=O)[O-])OC2=NC=C(C=C2)CN

DOS

IR

Vibrations