Geometry & MOs

Info

ID:	301111
PubChem CID:	123059905
Reduced:	NCl2O6H21C26 (1)
Stoich.:	AB2C6D21E26 (1)
Weight, g/mol:	521.220223
ΔH_f, kcal/mol:	-176.68
Dipole, Da:	6.9
IP(EA), eV:	-8.87(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=C(C=CC(=C3)Cl)O)C4=CC(=C(C=C4)O)Cl)/O

DOS

IR

Vibrations