Geometry & MOs

Info

ID:	431391
PubChem CID:	135171466
Reduced:	BrN2O2H13C15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	-39.35
Dipole, Da:	7.15
IP(EA), eV:	-9.37(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-benzyl-2-methoxy-7,8-dihydro-1,6-naphthyridin-5-one

Drug info:

PubChemData

Smile

C1CN(C(=O)C2=C1NC(=O)C(=C2)Br)CC3=CC=CC=C3

DOS

IR

Vibrations