Geometry & MOs

Info

ID:	230469
PubChem CID:	87570982
Reduced:	INSH4O5C8 (1)
Stoich.:	ABCD4E5F8 (1)
Weight, g/mol:	211.057917
ΔH_f, kcal/mol:	-133.8
Dipole, Da:	3.77
IP(EA), eV:	-10.42(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)S(=O)(=O)N=C=O)I)C(=O)O

DOS

IR

Vibrations