Geometry & MOs

Info

ID:	6847
PubChem CID:	70245
Reduced:	NS2O3C20H43 (1)
Stoich.:	AB2C3D20E43 (1)
Weight, g/mol:	409.268437
ΔH_f, kcal/mol:	-205.17
Dipole, Da:	2.28
IP(EA), eV:	-9.19(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-sulfosulfanylethylamino)octadecane

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCNCCSS(=O)(=O)O

DOS

IR

Vibrations