Geometry & MOs

Info

ID:	66474
PubChem CID:	46504642
Reduced:	BrON3C23H24 (1)
Stoich.:	ABC3D23E24 (1)
Weight, g/mol:	408.179755
ΔH_f, kcal/mol:	29.24
Dipole, Da:	1.46
IP(EA), eV:	-8.3(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-4-methylquinolin-6-yl]-4-methoxy-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)Br)C(=C1)C

DOS

IR

Vibrations