Geometry & MOs

Info

ID:	388680
PubChem CID:	134989863
Reduced:	C2S2O3H4N4 (1)
Stoich.:	A2B2C3D4E4 (1)
Weight, g/mol:	319.89726
ΔH_f, kcal/mol:	-20.76
Dipole, Da:	9.02
IP(EA), eV:	-9.07(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-iodo-5-propylsulfanyl-1lambda4,2-dithia-4-azacyclopenta-3,5-dien-3-amine

Drug info:

PubChemData

Smile

C1(=NC(=S(S1)O[N+](=O)[O-])N)N

DOS

IR

Vibrations