Geometry & MOs

Info

ID:	9540
PubChem CID:	90724
Reduced:	S2N3O3C6H15 (1)
Stoich.:	A2B3C3D6E15 (1)
Weight, g/mol:	241.055484
ΔH_f, kcal/mol:	-121.81
Dipole, Da:	1.25
IP(EA), eV:	-9.23(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N'-(2-sulfosulfanylethyl)carbamimidoyl]amino]propane

Drug info:

PubChemData

Smile

CC(C)NC(=NCCSS(=O)(=O)O)N

DOS

IR

Vibrations