Geometry & MOs

Info

ID:	26650
PubChem CID:	794457
Reduced:	FNSO3C13H18 (1)
Stoich.:	ABCD3E13F18 (1)
Weight, g/mol:	328.097855
ΔH_f, kcal/mol:	-162.94
Dipole, Da:	5.15
IP(EA), eV:	-9.3(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(3-chlorophenyl)-3-(3-ethylanilino)pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)OC

DOS

IR

Vibrations