Geometry & MOs

Info

ID:	308865
PubChem CID:	126531668
Reduced:	ClON3H18C19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	293.87624
ΔH_f, kcal/mol:	26.54
Dipole, Da:	3.26
IP(EA), eV:	-9.42(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-7,8-dichloro-3-fluoro-1,5-naphthyridine

Drug info:

PubChemData

Smile

CC1=C(C(=C2C=C(C=CC2=N1)C3=CN=C(N=C3)C(C)(C)O)C=C)Cl

DOS

IR

Vibrations