Geometry & MOs

Info

ID:	390239
PubChem CID:	134997964
Reduced:	N2O3H20C23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	546.188983
ΔH_f, kcal/mol:	-12.29
Dipole, Da:	4.52
IP(EA), eV:	-8.98(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 4,6-dibenzoyl-5-[(2-methylpropan-2-yl)oxycarbonyloxy]benzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

CC(=O)/C(=C(/C1=CC=CC=C1)\NC(=O)C2=CC=CC=N2)/OCC3=CC=CC=C3

DOS

IR

Vibrations