Geometry & MOs

Info

ID:	300758
PubChem CID:	123051132
Reduced:	FN2O3C31H31 (1)
Stoich.:	AB2C3D31E31 (1)
Weight, g/mol:	507.184586
ΔH_f, kcal/mol:	-90.01
Dipole, Da:	7.27
IP(EA), eV:	-8.04(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-5-(4-ethylphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C(=O)N2C4=CC=C(C=C4)N5CCC(CC5)C

DOS

IR

Vibrations