Geometry & MOs

Info

ID:	290747
PubChem CID:	109968828
Reduced:	ClN2O2C18H21 (1)
Stoich.:	AB2C2D18E21 (1)
Weight, g/mol:	271.124215
ΔH_f, kcal/mol:	-61.5
Dipole, Da:	3.85
IP(EA), eV:	-8.92(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylphenyl)-2-(1-methylsulfonylpropan-2-ylamino)ethanol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)NC(=O)CNC(CCO)C2=CC=CC=C2

DOS

IR

Vibrations