Geometry & MOs

Info

ID:	300774
PubChem CID:	123054774
Reduced:	BrNO4C30H30 (1)
Stoich.:	ABC4D30E30 (1)
Weight, g/mol:	533.12017
ΔH_f, kcal/mol:	-90.04
Dipole, Da:	11.44
IP(EA), eV:	-8.86(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(3-bromophenyl)-4-[hydroxy-(4-pentoxyphenyl)methylidene]-5-(2-methylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCCCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=CC=C3)Br)C4=CC=C(C=C4)CC)/O

DOS

IR

Vibrations