Geometry & MOs

Info

ID:	278328
PubChem CID:	103834846
Reduced:	NO3S3C9H15 (1)
Stoich.:	AB3C3D9E15 (1)
Weight, g/mol:	333.106851
ΔH_f, kcal/mol:	-97.08
Dipole, Da:	5.63
IP(EA), eV:	-8.86(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-hydroxypropylsulfanyl)ethyl]-4-methoxy-2,6-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CSC(=C1)S(=O)(=O)NCCSCCCO

DOS

IR

Vibrations