Geometry & MOs

Info

ID:

301160

PubChem CID:

123060570

Reduced:

NO4C15H15 (2)

Stoich.:

AB4C15D15 (2)

Weight, g/mol:

545.241352

ΔHf, kcal/mol:

-229.71

Dipole, Da:

11.07

IP(EA), eV:

 -8.35(-1.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-4-[(2,5-dimethoxyphenyl)-hydroxymethylidene]-1-(3,5-dimethylphenyl)-5-(3-ethoxy-4-propan-2-yloxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2/C(=C(/C3=C(C=CC(=C3)OC)OC)\O)/C(=O)C(=O)N2C4=CC=CC(=C4)NC(=O)C)OC

DOS

IR

Vibrations