Geometry & MOs

Info

ID:	278325
PubChem CID:	103834834
Reduced:	N2S2O3C9H22 (1)
Stoich.:	A2B2C3D9E22 (1)
Weight, g/mol:	271.054815
ΔH_f, kcal/mol:	-143.99
Dipole, Da:	4.21
IP(EA), eV:	-8.86(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(3-hydroxypropylsulfanyl)ethylsulfamoyl]acetate

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)NCCSCCCO

DOS

IR

Vibrations