Geometry & MOs

Info

ID:	11159
PubChem CID:	111523
Reduced:	ClNSH4O4C6 (1)
Stoich.:	ABCD4E4F6 (1)
Weight, g/mol:	220.954957
ΔH_f, kcal/mol:	-55.16
Dipole, Da:	5.09
IP(EA), eV:	-9.7(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-nitrobenzenesulfinic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)O)Cl

DOS

IR

Vibrations