Geometry & MOs

Info

ID:	301130
PubChem CID:	123059989
Reduced:	ClNO6H28C30 (1)
Stoich.:	ABC6D28E30 (1)
Weight, g/mol:	525.03425
ΔH_f, kcal/mol:	-180.64
Dipole, Da:	9.34
IP(EA), eV:	-8.99(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(3-bromophenyl)-5-(4-chlorophenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations