Geometry & MOs

Info

ID:	300756
PubChem CID:	123051127
Reduced:	FNO6H28C30 (1)
Stoich.:	ABC6D28E30 (1)
Weight, g/mol:	484.216221
ΔH_f, kcal/mol:	-213.39
Dipole, Da:	7.42
IP(EA), eV:	-9.27(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-5-(4-ethylphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(4-piperidin-1-ylphenyl)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)C(=O)OCCOCC

DOS

IR

Vibrations