Geometry & MOs

Info

ID:	143268
PubChem CID:	53176619
Reduced:	ClFN3O3H9C17 (1)
Stoich.:	ABC3D3E9F17 (1)
Weight, g/mol:	347.126991
ΔH_f, kcal/mol:	-43.86
Dipole, Da:	2.11
IP(EA), eV:	-9.04(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[3-(4-ethylphenyl)-2H-1,2,4-oxadiazol-5-ylidene]-6-methyl-1H-quinoline-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)/C(=C/3\N=C(NO3)C4=CC(=C(C=C4)F)Cl)/C(=O)N2

DOS

IR

Vibrations