Geometry & MOs

Info

ID:

432794

PubChem CID:

135172931

Reduced:

O2H29C43 (2)

Stoich.:

A2B29C43 (2)

Weight, g/mol:

902.33961

ΔHf, kcal/mol:

177.51

Dipole, Da:

3.38

IP(EA), eV:

 -8.07(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[4-[4-[3,4-bis(4-hydroxyphenyl)-2,5-diphenylphenyl]phenyl]-2-(4-hydroxyphenyl)-3,6-diphenylphenyl]phenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)C5=CC=CC=C5)C6=C7C=CC=CC7=C(C8=CC=CC=C86)C9=C(C(=C(C(=C9C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations