Geometry & MOs

Info

ID:	226540
PubChem CID:	87457847
Reduced:	SO7C28H60 (1)
Stoich.:	AB7C28D60 (1)
Weight, g/mol:	618.183109
ΔH_f, kcal/mol:	-436.91
Dipole, Da:	4.23
IP(EA), eV:	-9.73(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ditriphenylen-1-yl benzene-1,4-dicarboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCC(CCCO)OC(CCCCCCCCCC)CCCO.OS(=O)(=O)O

DOS

IR

Vibrations