Geometry & MOs

Info

ID:

334952

PubChem CID:

127253758

Reduced:

O4H15C18 (2)

Stoich.:

A4B15C18 (2)

Weight, g/mol:

620.204633

ΔHf, kcal/mol:

-191.88

Dipole, Da:

6.62

IP(EA), eV:

 -8.38(-1.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-9-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-4-methoxyphenyl]-2-[(3,4-dimethoxyphenyl)methylidene]-8,9-dihydrofuro[2,3-f]chromene-3,7-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C4=C(C=C3)OC(=O)CC4C5=CC=CC=C5OCCC6=CC7=C(C=C6)OCC7)OC

DOS

IR

Vibrations