Geometry & MOs

Info

ID:	338259
PubChem CID:	127258951
Reduced:	BrON3H14C16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	339.03711
ΔH_f, kcal/mol:	32.35
Dipole, Da:	2.63
IP(EA), eV:	-8.51(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-3-ethenyl-1,7-naphthyridin-8-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC2=NC=CC3=CC(=CN=C32)CO

DOS

IR

Vibrations