Geometry & MOs

Info

ID:	338769
PubChem CID:	127259780
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	409.134779
ΔH_f, kcal/mol:	-50.26
Dipole, Da:	3.01
IP(EA), eV:	-8.3(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(N-(4-methylphenyl)sulfonylanilino)ethyl 2-phenylacetate

Drug info:

PubChemData

Smile

CC(CN(C)C1=CC=CC=C1)OC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations