Geometry & MOs

Info

ID:

190880

PubChem CID:

78071928

Reduced:

O6N11C37H47 (1)

Stoich.:

A6B11C37D47 (1)

Weight, g/mol:

415.189592

ΔHf, kcal/mol:

-173.81

Dipole, Da:

9.36

IP(EA), eV:

 -8.99(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-(2,4-dimethylphenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

C1CN(CCC12C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N2)CC3=CC=C(C=C3)O)CC4=CC5=CC=CC=C5C=C4)CCCN=C(N)N)C(=N)N

DOS

IR

Vibrations