Geometry & MOs

Info

ID:	6740
PubChem CID:	69779
Reduced:	O2H7C10 (2)
Stoich.:	A2B7C10 (2)
Weight, g/mol:	318.089209
ΔH_f, kcal/mol:	-76.71
Dipole, Da:	2.19
IP(EA), eV:	-9.47(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diphenyl benzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3

DOS

IR

Vibrations