Geometry & MOs

Info

ID:	4055
PubChem CID:	10654
Reduced:	O2H9C11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	346.120509
ΔH_f, kcal/mol:	-93.46
Dipole, Da:	3.81
IP(EA), eV:	-9.7(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzyl benzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations