Geometry & MOs

Info

ID:

335157

PubChem CID:

127254018

Reduced:

SN4O8C35H42 (1)

Stoich.:

AB4C8D35E42 (1)

Weight, g/mol:

474.131468

ΔHf, kcal/mol:

-250.35

Dipole, Da:

8.21

IP(EA), eV:

 -8.25(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-9-(4-hydroxy-3-methoxyphenyl)-8,9-dihydrofuro[2,3-f]chromene-3,7-dione

Drug info:

PubChemData

Smile

CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NCCCC(=O)NC4=CC=C(C=C4)N5CCCCS5(=O)=O)OC)OC)OC

DOS

IR

Vibrations