Geometry & MOs

Info

ID:	9356
PubChem CID:	88403
Reduced:	O2C13H13 (2)
Stoich.:	A2B13C13 (2)
Weight, g/mol:	402.183109
ΔH_f, kcal/mol:	-112.06
Dipole, Da:	0.93
IP(EA), eV:	-9.35(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(3-phenylpropyl) benzene-1,2-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCCOC(=O)C2=CC=CC=C2C(=O)OCCCC3=CC=CC=C3

DOS

IR

Vibrations