Geometry & MOs

Info

ID:	320724
PubChem CID:	126663123
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	439.13582
ΔH_f, kcal/mol:	-37.04
Dipole, Da:	5.95
IP(EA), eV:	-9.25(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-bromo-1-(1-butoxyethoxy)ethyl]-8-butoxy-1H-quinolin-2-one

Drug info:

PubChemData

Smile

C1CC2(CCC(=O)ON2)CNC1C3=CC=CC=C3

DOS

IR

Vibrations