Geometry & MOs

Info

ID:	304595
PubChem CID:	124756429
Reduced:	ON4C20H28 (1)
Stoich.:	AB4C20D28 (1)
Weight, g/mol:	299.108835
ΔH_f, kcal/mol:	-9.74
Dipole, Da:	2.88
IP(EA), eV:	-8.89(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[(2-chloro-5-fluoro-4-methylphenyl)methyl]-1-(2-methoxyethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](CN1C=CN=C1)NC(=O)CN2CCC3=CC=CC=C3C2

DOS

IR

Vibrations