Geometry & MOs

Info

ID:

312130

PubChem CID:

126603320

Reduced:

N2O3C14H18 (2)

Stoich.:

A2B3C14D18 (2)

Weight, g/mol:

850.30831

ΔHf, kcal/mol:

-218.81

Dipole, Da:

9.25

IP(EA), eV:

 -8.78(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[11-(3-hydroxyphenyl)-7-[2-methoxy-4-[11-(3-methoxyphenyl)triphenylen-2-yl]phenyl]triphenylen-2-yl]phenol

Drug info:

PubChemData

Smile

CCN1CCC(C2=CC(=C3C(=C21)C[C@@H]4C[C@H]5[C@H](C(=O)C4=C3O)C(=O)C(=C([C@@H]5N(C)C)O)C(=O)N)O)N(C)C

DOS

IR

Vibrations