Geometry & MOs

Info

ID:	136788
PubChem CID:	52100441
Reduced:	S2O3N4H10C14 (1)
Stoich.:	A2B3C4D10E14 (1)
Weight, g/mol:	447.992557
ΔH_f, kcal/mol:	-36.05
Dipole, Da:	3.88
IP(EA), eV:	-8.74(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[4-(2,4-dichlorophenoxy)phenyl]-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]azanide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4

DOS

IR

Vibrations