Geometry & MOs

Info

ID:	338258
PubChem CID:	127258950
Reduced:	BrClON3H11C14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	343.03202
ΔH_f, kcal/mol:	43.12
Dipole, Da:	3.9
IP(EA), eV:	-9.48(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-(3-bromo-2-methylanilino)-1,7-naphthyridin-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)C2=NN3C=C(C=C(C3=N2)Cl)CO

DOS

IR

Vibrations