Geometry & MOs

Info

ID:	263611
PubChem CID:	103382862
Reduced:	SO2N4C11H18 (1)
Stoich.:	AB2C4D11E18 (1)
Weight, g/mol:	325.022469
ΔH_f, kcal/mol:	-66.81
Dipole, Da:	5.84
IP(EA), eV:	-8.54(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(1,1-dioxothian-4-yl)-4-methylsulfonyl-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CN1CCC(CC1)NC2=C(C(=NS2)N)C(=O)OC

DOS

IR

Vibrations