Geometry & MOs

Info

ID:	183090
PubChem CID:	76977435
Reduced:	NOC16H21 (1)
Stoich.:	ABC16D21 (1)
Weight, g/mol:	309.03644
ΔH_f, kcal/mol:	-18.64
Dipole, Da:	3.97
IP(EA), eV:	-9.19(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-8-methoxy-2-methyl-3-propan-2-yl-8H-quinolin-4-one

Drug info:

PubChemData

Smile

CCCC1C=CC=C2C1=NC(=C(C2=O)C(C)C)C

DOS

IR

Vibrations