Geometry & MOs

Info

ID:	10847
PubChem CID:	108512
Reduced:	ClSN2C3H7 (2)
Stoich.:	ABC2D3E7 (2)
Weight, g/mol:	276.003694
ΔH_f, kcal/mol:	-24.01
Dipole, Da:	0.69
IP(EA), eV:	-9.54(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-carbamimidoylsulfanylbut-2-enyl carbamimidothioate;dihydrochloride

Drug info:

PubChemData

Smile

C(C=CCSC(=N)N)SC(=N)N.Cl.Cl

DOS

IR

Vibrations