Geometry & MOs

Info

ID:	78886
PubChem CID:	49742642
Reduced:	ClN2O3H17C19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	326.090272
ΔH_f, kcal/mol:	-87.84
Dipole, Da:	6.4
IP(EA), eV:	-8.87(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-2-oxo-1H-quinolin-7-yl]-6-oxopyran-3-carboxamide

Drug info:

PubChemData

Smile

COCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)CC3=CC=CC=C3Cl

DOS

IR

Vibrations