Geometry & MOs

Info

ID:	216112
PubChem CID:	85085749
Reduced:	NO2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	229.110279
ΔH_f, kcal/mol:	9.83
Dipole, Da:	2.74
IP(EA), eV:	-9.66(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-2-methyl-3H-quinolin-4-one

Drug info:

PubChemData

Smile

C=CCC1C2CON=C2C(O1)C3=CC=CC=C3

DOS

IR

Vibrations