Geometry & MOs

Info

ID:	26660
PubChem CID:	794489
Reduced:	ClO2N3H8C14 (1)
Stoich.:	AB2C3D8E14 (1)
Weight, g/mol:	268.051778
ΔH_f, kcal/mol:	92.31
Dipole, Da:	3.38
IP(EA), eV:	-9.84(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethoxyphenyl)sulfonylimidazole

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C#N

DOS

IR

Vibrations