Geometry & MOs

Info

ID:	188478
PubChem CID:	77722658
Reduced:	ClFNSO3C18H21 (1)
Stoich.:	ABCDE3F18G21 (1)
Weight, g/mol:	445.111457
ΔH_f, kcal/mol:	-144.38
Dipole, Da:	5.27
IP(EA), eV:	-8.96(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-2-[2-[4-(2-methoxyphenyl)sulfonylphenyl]ethylamino]ethanol

Drug info:

PubChemData

Smile

CCC(C)C(COC1=CC=C(C=C1)Cl)NS(=O)(=O)C2=CC=CC=C2F

DOS

IR

Vibrations