Geometry & MOs

Info

ID:	231954
PubChem CID:	87574993
Reduced:	FN3O3H16C18 (1)
Stoich.:	AB3C3D16E18 (1)
Weight, g/mol:	417.96323
ΔH_f, kcal/mol:	-64.46
Dipole, Da:	5.24
IP(EA), eV:	-8.05(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[5-bromo-2-(2-chloro-6-fluorophenyl)imidazol-4-ylidene]-3-phenyl-2H-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC(=CNC3=O)F

DOS

IR

Vibrations