Geometry & MOs

Info

ID:	78954
PubChem CID:	49742843
Reduced:	N3O4H19C20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-57.56
Dipole, Da:	4.09
IP(EA), eV:	-9.06(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylphenyl)-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations