Geometry & MOs

Info

ID:	388672
PubChem CID:	134989837
Reduced:	SN2O2H10C12 (1)
Stoich.:	AB2C2D10E12 (1)
Weight, g/mol:	291.86596
ΔH_f, kcal/mol:	35.69
Dipole, Da:	3.16
IP(EA), eV:	-9.75(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C(CC2=NOS3=C2C1=NO3)C4=CC=CC=C4

DOS

IR

Vibrations