Geometry & MOs

Info

ID:	431390
PubChem CID:	135171465
Reduced:	SO2Cl3N5H14C17 (1)
Stoich.:	AB2C3D5E14F17 (1)
Weight, g/mol:	332.01604
ΔH_f, kcal/mol:	24.15
Dipole, Da:	3.97
IP(EA), eV:	-8.99(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-benzyl-3-bromo-7,8-dihydro-1H-1,6-naphthyridine-2,5-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)Cl)SNC2=CC3=C(N=C2)OCCN4C3=NN=C4C(Cl)Cl

DOS

IR

Vibrations