Geometry & MOs

Info

ID:

398004

PubChem CID:

135031322

Reduced:

O5H19C22 (2)

Stoich.:

A5B19C22 (2)

Weight, g/mol:

1226.408871

ΔHf, kcal/mol:

-224.6

Dipole, Da:

4.37

IP(EA), eV:

 -8.94(-0.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-carboxy-4-[6-carboxy-2,3,4-tris(phenylmethoxy)phenoxy]-2,3-bis(phenylmethoxy)phenyl]-3,4,5-tris(phenylmethoxy)benzoic acid

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(C(=C1)OC2=C(C(=C(C=C2C(=O)OC)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)O

DOS

IR

Vibrations