Geometry & MOs

Info

ID:	224933
PubChem CID:	85730947
Reduced:	ClON2F3H6C11 (1)
Stoich.:	ABC2D3E6F11 (1)
Weight, g/mol:	307.973103
ΔH_f, kcal/mol:	-80.84
Dipole, Da:	1.64
IP(EA), eV:	-9.66(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dichlorophenyl)-5-(2,3,3-trifluoroprop-2-enyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=NOC(=N2)CC(=C(F)F)F)Cl

DOS

IR

Vibrations