Geometry & MOs

Info

ID:	413557
PubChem CID:	135086506
Reduced:	ClN2O2H7C10 (1)
Stoich.:	AB2C2D7E10 (1)
Weight, g/mol:	223.02743
ΔH_f, kcal/mol:	30.59
Dipole, Da:	5.62
IP(EA), eV:	-9.1(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-(4-chlorophenyl)-4-ethenyl-2H-oxadiazol-3-ium-5-one

Drug info:

PubChemData

Smile

C=CC1=C(ON=[N+]1C2=CC=C(C=C2)Cl)[O-]

DOS

IR

Vibrations