Geometry & MOs

Info

ID:

300606

PubChem CID:

123044992

Reduced:

ClNO6H26C29 (1)

Stoich.:

ABC6D26E29 (1)

Weight, g/mol:

544.257337

ΔHf, kcal/mol:

-168.96

Dipole, Da:

11.17

IP(EA), eV:

 -8.71(-0.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-1-[4-(diethylamino)phenyl]-5-(3-hydroxy-4-methoxyphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)/C(=C/2\C(N(C(=O)C2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC(=O)C)/O

DOS

IR

Vibrations