Geometry & MOs

Info

ID:	79002
PubChem CID:	49743039
Reduced:	ClN2O2H15C18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	328.102334
ΔH_f, kcal/mol:	-49.81
Dipole, Da:	5.27
IP(EA), eV:	-8.94(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-2-oxo-1H-quinolin-7-yl)-3,4-difluorobenzamide

Drug info:

PubChemData

Smile

CCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations