Geometry & MOs

Info

ID:	32563
PubChem CID:	7844841
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	339.110673
ΔH_f, kcal/mol:	-129.15
Dipole, Da:	5.74
IP(EA), eV:	-8.86(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dioxoisoindol-2-yl)methyl 2-(4-ethylphenoxy)acetate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC(=O)O[C@H](C)C(=O)NC2=CC=CC=C2

DOS

IR

Vibrations