Geometry & MOs

Info

ID:	21985
PubChem CID:	594530
Reduced:	NOC22H33 (1)
Stoich.:	ABC22D33 (1)
Weight, g/mol:	327.256215
ΔH_f, kcal/mol:	-67.72
Dipole, Da:	6.49
IP(EA), eV:	-8.8(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tridecyl-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC1=CC(=O)C2=CC=CC=C2N1

DOS

IR

Vibrations