Geometry & MOs

Info

ID:	6879
PubChem CID:	70376
Reduced:	NS2O3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	261.049336
ΔH_f, kcal/mol:	-101.11
Dipole, Da:	1.76
IP(EA), eV:	-9.19(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-sulfosulfanylethylamino)ethylbenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNCCSS(=O)(=O)O

DOS

IR

Vibrations