Geometry & MOs

Info

ID:

301113

PubChem CID:

123059914

Reduced:

N2O4H34C35 (1)

Stoich.:

A2B4C34D35 (1)

Weight, g/mol:

532.236208

ΔHf, kcal/mol:

-58.24

Dipole, Da:

8.86

IP(EA), eV:

 -7.76(-0.86)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]-5-naphthalen-1-yl-1-(4-pyrrolidin-1-ylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)/C(=C/2\C(N(C(=O)C2=O)C3=CC=C(C=C3)N4CCCCC4)C5=CC=CC6=CC=CC=C65)/O

DOS

IR

Vibrations