Geometry & MOs

Info

ID:

300705

PubChem CID:

123050939

Reduced:

N2O5H28C29 (1)

Stoich.:

A2B5C28D29 (1)

Weight, g/mol:

475.155036

ΔHf, kcal/mol:

-133.63

Dipole, Da:

11.81

IP(EA), eV:

-8.34(-1.0)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4E)-1-(4-chloro-2-methylphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(\C3=CC=C(C=C3)C)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)NC(=O)C

DOS

IR

Vibrations