Geometry & MOs

Info

ID:	300773
PubChem CID:	123054773
Reduced:	NO6C33H35 (1)
Stoich.:	AB6C33D35 (1)
Weight, g/mol:	547.13582
ΔH_f, kcal/mol:	-183.7
Dipole, Da:	10.48
IP(EA), eV:	-8.85(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(3-bromophenyl)-5-(4-ethylphenyl)-4-[hydroxy-(4-pentoxyphenyl)methylidene]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)C(=O)OCC)C4=CC=C(C=C4)CC)/O

DOS

IR

Vibrations