Geometry & MOs

Info

ID:	86520
PubChem CID:	49886596
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	313.134779
ΔH_f, kcal/mol:	-118.68
Dipole, Da:	3.7
IP(EA), eV:	-9.22(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-(4-ethyl-N-ethylsulfonylanilino)acetate

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1C(=O)CC)O

DOS

IR

Vibrations