Geometry & MOs

Info

ID:	31401
PubChem CID:	855672
Reduced:	SN2O2C18H22 (1)
Stoich.:	AB2C2D18E22 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-56.38
Dipole, Da:	2.46
IP(EA), eV:	-8.54(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC2=CC=CC(=C2N=C1SCC(=O)N3CCOCC3)C

DOS

IR

Vibrations