Geometry & MOs

Info

ID:	31381
PubChem CID:	855641
Reduced:	N2O4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	302.163043
ΔH_f, kcal/mol:	-117.13
Dipole, Da:	4.63
IP(EA), eV:	-8.86(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(=O)N(CC1=CC=CO1)CC2=CC3=C(C=C(C=C3)OC)NC2=O

DOS

IR

Vibrations