Geometry & MOs

Info

ID:

334240

PubChem CID:

127252792

Reduced:

SN5O6C36H43 (1)

Stoich.:

AB5C6D36E43 (1)

Weight, g/mol:

518.157682

ΔHf, kcal/mol:

-137.95

Dipole, Da:

1.24

IP(EA), eV:

 -8.55(-0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-9-(2,4,5-trimethoxyphenyl)-8,9-dihydrofuro[2,3-f]chromene-3,7-dione

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1C)NC3=CC=C4C(=CC3=O)[C@H](CCC5=CC(=C(C(=C54)OC)OC)OC)NC(=O)C

DOS

IR

Vibrations