Geometry & MOs

Info

ID:	278313
PubChem CID:	103834782
Reduced:	N2S2O4C13H20 (1)
Stoich.:	A2B2C4D13E20 (1)
Weight, g/mol:	317.111936
ΔH_f, kcal/mol:	-159.0
Dipole, Da:	6.45
IP(EA), eV:	-8.69(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-hydroxypropylsulfanyl)ethyl]-4-propylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCSCCCO

DOS

IR

Vibrations