Geometry & MOs

Info

ID:	336959
PubChem CID:	127256114
Reduced:	Br2N2O2H8C11 (1)
Stoich.:	A2B2C2D8E11 (1)
Weight, g/mol:	251.95344
ΔH_f, kcal/mol:	-23.47
Dipole, Da:	5.71
IP(EA), eV:	-10.07(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1,8-naphthyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=CC(=CN=C2N=C1Br)Br

DOS

IR

Vibrations