Geometry & MOs

Info

ID:	88893
PubChem CID:	49957415
Reduced:	SO3N4H14C16 (1)
Stoich.:	AB3C4D14E16 (1)
Weight, g/mol:	266.047361
ΔH_f, kcal/mol:	28.51
Dipole, Da:	7.62
IP(EA), eV:	-9.12(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methyl-5-nitrobenzimidazol-2-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1SCC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations