Geometry & MOs

Info

ID:	35809
PubChem CID:	7980351
Reduced:	NO4H19C20 (1)
Stoich.:	AB4C19D20 (1)
Weight, g/mol:	406.119858
ΔH_f, kcal/mol:	-101.97
Dipole, Da:	4.27
IP(EA), eV:	-8.84(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[3-(dimethylsulfamoyl)anilino]-1-oxopropan-2-yl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C)OC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations