Geometry & MOs

Info

ID:	279224
PubChem CID:	103842165
Reduced:	BrClN2O3H10C14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	349.98215
ΔH_f, kcal/mol:	-1.94
Dipole, Da:	2.33
IP(EA), eV:	-10.06(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-chlorophenyl)-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])CNC(=O)C2=CC(=C(C=C2)Cl)Br

DOS

IR

Vibrations