Geometry & MOs

Info

ID:	109
PubChem CID:	2129
Reduced:	SCl2N2O4C19H24 (1)
Stoich.:	AB2C2D4E19F24 (1)
Weight, g/mol:	446.083384
ΔH_f, kcal/mol:	-143.91
Dipole, Da:	6.5
IP(EA), eV:	-8.64(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-[2-(3,4-dichlorophenyl)ethyl-methylamino]-2-hydroxypropoxy]phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN(CCC1=CC(=C(C=C1)Cl)Cl)CC(COC2=CC=C(C=C2)NS(=O)(=O)C)O

DOS

IR

Vibrations