Geometry & MOs

Info

ID:

378909

PubChem CID:

134225012

Reduced:

N2H29C33 (2)

Stoich.:

A2B29C33 (2)

Weight, g/mol:

564.23006

ΔHf, kcal/mol:

211.36

Dipole, Da:

5.32

IP(EA), eV:

 -8.02(-0.57)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3-[2-hydroxy-3-(2-hydroxyphenyl)phenyl]-2-(4-phenylphenyl)propyl]-6-(2-hydroxyphenyl)phenol

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1N2C3=CC=CC=C3C4=CC5=C(C=C42)C6=CC=CC=C6C5(C)C)N=C(C7=CC=CC=C7N8C9=CC=CC=C9C1=CC2=C(C=C18)C1=C(C2(C)C)CCCC1)NC(=C)C1=CC=CC=C1

DOS

IR

Vibrations