Geometry & MOs

Info

ID:

300695

PubChem CID:

123050876

Reduced:

NO4C30H31 (1)

Stoich.:

AB4C30D31 (1)

Weight, g/mol:

469.225308

ΔHf, kcal/mol:

-101.25

Dipole, Da:

7.77

IP(EA), eV:

-8.36(-0.84)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4E)-1-(2,5-dimethylphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-[3-(2-methylpropoxy)phenyl]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=C(C=C3)C)C)C4=CC(=CC=C4)OCC(C)C)/O

DOS

IR

Vibrations