Geometry & MOs

Info

ID:	15319
PubChem CID:	438021
Reduced:	O4H18C21 (2)
Stoich.:	A4B18C21 (2)
Weight, g/mol:	668.241018
ΔH_f, kcal/mol:	-162.82
Dipole, Da:	4.09
IP(EA), eV:	-8.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 1,4,5,8-tetrakis(phenylmethoxy)naphthalene-2,3-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C2=C(C=CC(=C2C(=C1C(=O)OC)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

DOS

IR

Vibrations