Geometry & MOs

Info

ID:	300709
PubChem CID:	123050958
Reduced:	FNO5H30C31 (1)
Stoich.:	ABC5D30E31 (1)
Weight, g/mol:	472.179835
ΔH_f, kcal/mol:	-187.13
Dipole, Da:	5.77
IP(EA), eV:	-9.18(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-2,3-dioxo-5-(4-propan-2-ylphenyl)pyrrolidin-1-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)COC(=O)C1=CC=C(C=C1)N2C(/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C2=O)C4=CC=C(C=C4)C(C)C

DOS

IR

Vibrations