Geometry & MOs

Info

ID:	300713
PubChem CID:	123051050
Reduced:	FN2O4H25C28 (1)
Stoich.:	AB2C4D25E28 (1)
Weight, g/mol:	486.195486
ΔH_f, kcal/mol:	-115.65
Dipole, Da:	6.32
IP(EA), eV:	-7.83(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-[4-(4-methylpiperidin-1-yl)phenyl]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC=C(C=C2)N3C(/C(=C(/C4=CC=C(C=C4)F)\O)/C(=O)C3=O)C5=CC(=CC=C5)O

DOS

IR

Vibrations