Geometry & MOs

Info

ID:

301066

PubChem CID:

123059717

Reduced:

NO7C31H33 (1)

Stoich.:

AB7C31D33 (1)

Weight, g/mol:

529.246438

ΔHf, kcal/mol:

-207.13

Dipole, Da:

5.56

IP(EA), eV:

 -8.36(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-5-(3,4-diethoxyphenyl)-1-(2,5-dimethylphenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations