Geometry & MOs

Info

ID:	373564
PubChem CID:	131317325
Reduced:	ClSN2H3O5C7 (1)
Stoich.:	ABC2D3E5F7 (1)
Weight, g/mol:	261.94512
ΔH_f, kcal/mol:	-59.78
Dipole, Da:	9.34
IP(EA), eV:	-11.03(-2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-3-hydroxy-2-nitrobenzenesulfonyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1C#N)[N+](=O)[O-])S(=O)(=O)Cl)O

DOS

IR

Vibrations