Geometry & MOs

Info

ID:	31377
PubChem CID:	855637
Reduced:	ON2S3H10C13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	334.152872
ΔH_f, kcal/mol:	53.66
Dipole, Da:	4.28
IP(EA), eV:	-8.61(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)NC(=O)C2=CC=CS2)C3=CC=CS3

DOS

IR

Vibrations