Geometry & MOs

Info

ID:	28080
PubChem CID:	825429
Reduced:	SN3O4H9C11 (1)
Stoich.:	AB3C4D9E11 (1)
Weight, g/mol:	279.095595
ΔH_f, kcal/mol:	-22.71
Dipole, Da:	6.83
IP(EA), eV:	-9.37(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5,7-diphenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-4-ium

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)NC(=S)N2)[N+](=O)[O-]

DOS

IR

Vibrations