Geometry & MOs

Info

ID:

301105

PubChem CID:

123059871

Reduced:

ClNO6H26C28 (1)

Stoich.:

ABC6D26E28 (1)

Weight, g/mol:

534.19215

ΔHf, kcal/mol:

-178.5

Dipole, Da:

7.98

IP(EA), eV:

 -8.68(-1.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-5-(3-chloro-4-hydroxyphenyl)-1-[4-(diethylamino)phenyl]-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)N2C(/C(=C(\C3=CC(=CC=C3)OC(C)C)/O)/C(=O)C2=O)C4=CC(=C(C=C4)O)Cl

DOS

IR

Vibrations